NP-MRD: Showing NP-Card for Stigmasterol (NP0001428)

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Record Information

Version

1.0

Created at

2005-11-16 15:48:42 UTC

Updated at

2024-04-19 10:07:01 UTC

NP-MRD ID

NP0001428

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Stigmasterol

Description

Stigmasterol is a phytosterol, meaning it is steroid derived from plants. As a food additive, phytosterols have cholesterol-lowering properties (reducing cholesterol absorption in intestines), and may act in cancer prevention. Phytosterols naturally occur in small amount in vegetable oils, especially soybean oil. One such phytosterol complex, isolated from vegetable oil, is cholestatin, composed of campesterol, stigmasterol, and brassicasterol, and is marketed as a dietary supplement. Sterols can reduce cholesterol in human subjects by up to 15%. The mechanism behind phytosterols and the lowering of cholesterol occurs as follows: The incorporation of cholesterol into micelles in the gastrointestinal tract is inhibited, decreasing the overall amount of cholesterol absorbed. This may in turn help to control body total cholesterol levels, as well as modify HDL, LDL and TAG levels. Many margarines, butters, breakfast cereals and spreads are now enriched with phytosterols and marketed towards people with high cholesterol and a wish to lower it. Stigmasterol is found to be associated with phytosterolemia, which is an inborn error of metabolism.

Structure

MOL 3D MOL SDF 3D SDF PDB 3D PDB SMILES InChI


  Mrv1652309272007292D          

 34 37  0  0  0  0            999 V2000
 9999.976210000.6420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9997.8380 9999.3952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 9998.5507 9998.1599    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
 9999.2635 9999.3952    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
 9999.9762 9998.1599    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
 9997.1240 9998.9779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9996.4095 9998.5654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 13 19  1  0  0  0  0
 16 20  1  0  0  0  0
 20  6  1  6  0  0  0
 19  1  1  1  0  0  0
M  END

HMDB0000937
     RDKit          3D
Stigmasterol
 78 81  0  0  0  0  0  0  0  0999 V2000
    7.9389    1.6838   -0.1052 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5555    1.5718    0.4023 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.2334    1.0149    0.3000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END


  Mrv1652309272007292D          

 34 37  0  0  0  0            999 V2000
 9999.976210000.6420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 21 22  1  0  0  0  0
 23 24  1  0  0  0  0
 23 34  1  6  0  0  0
 24 25  1  0  0  0  0
 24 33  1  6  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 31  1  1  0  0  0
 28 29  1  0  0  0  0
 28 30  1  0  0  0  0
 31 32  1  0  0  0  0
 23 19  1  0  0  0  0
 23 22  1  0  0  0  0
 13 19  1  0  0  0  0
 16 20  1  0  0  0  0
 20  6  1  6  0  0  0
 19  1  1  1  0  0  0
M  END
> <DATABASE_ID>
NP0001428

> <DATABASE_NAME>
NP-MRD

> <SMILES>
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)\C=C\[C@@H](CC)C(C)C

> <INCHI_IDENTIFIER>
InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-10,19-21,23-27,30H,7,11-18H2,1-6H3/b9-8+/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1

> <INCHI_KEY>
HCXVJBMSMIARIN-PHZDYDNGSA-N

> <FORMULA>
C29H48O

> <MOLECULAR_WEIGHT>
412.702

> <EXACT_MASS>
412.370516166

> <JCHEM_ACCEPTOR_COUNT>
1

> <JCHEM_ATOM_COUNT>
78

> <JCHEM_AVERAGE_POLARIZABILITY>
53.55229580663386

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(1S,2R,5S,10S,11S,14R,15R)-14-[(2R,3E,5S)-5-ethyl-6-methylhept-3-en-2-yl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-7-en-5-ol

> <ALOGPS_LOGP>
6.95

> <JCHEM_LOGP>
7.482555135333334

> <ALOGPS_LOGS>
-7.18

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_ACIDIC>
18.20428950550382

> <JCHEM_PKA_STRONGEST_BASIC>
-1.3972437702926293

> <JCHEM_POLAR_SURFACE_AREA>
20.23

> <JCHEM_REFRACTIVITY>
130.88269999999997

> <JCHEM_ROTATABLE_BOND_COUNT>
5

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
2.73e-05 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(1S,2R,5S,10S,11S,14R,15R)-14-[(2R,3E,5S)-5-ethyl-6-methylhept-3-en-2-yl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-7-en-5-ol

> <JCHEM_VEBER_RULE>
1

$$$$

HMDB0000937
     RDKit          3D
Stigmasterol
 78 81  0  0  0  0  0  0  0  0999 V2000
    7.9389    1.6838   -0.1052 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5555    1.5718    0.4023 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5152    0.9911   -0.4689 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.2334    1.0149    0.3000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4128    0.0203    0.4068 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1200    0.0573    1.1882 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.0007    1.2328    2.0693 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0319   -0.2189    0.2382 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.1959   -1.5793   -0.4145 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2175   -2.0768   -0.7327 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0249   -0.8520   -0.4899 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.4932   -1.0330   -0.3795 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.0404   -1.2269   -1.7791 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3599   -0.6315   -1.9866 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1373   -0.0695   -1.0692 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4568    0.4861   -1.4727 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0764    1.3660   -0.4477 C   0  0  1  0  0  0  0  0  0  0  0  0
   -8.4572    1.4235   -0.5905 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7805    0.8618    0.9540 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2880    1.0037    1.1425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6108   -0.0406    0.3226 C   0  0  1  0  0  0  0  0  0  0  0  0
   -4.7603   -1.3796    1.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1228    0.1985    0.1807 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.4728    0.7251    1.4105 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0177    1.0215    1.0145 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3628   -0.2883    0.7627 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.5569   -1.2971    1.8499 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7818   -0.3180   -1.1090 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9602   -0.3362   -2.0336 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0140   -1.4282   -0.0862 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4948    0.7616   -0.2633 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0283    2.4323   -0.9455 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5192    2.2126    0.7212 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2199    2.6292    0.6363 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5862    1.1024    1.4298 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3434    1.7242   -1.3076 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9950    1.9484    0.7977 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6203   -0.9040   -0.0759 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2060   -0.8274    1.8671 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3802    0.9663    2.9555 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0273    1.4189    2.5124 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7225    2.1769    1.5940 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0231    0.5124   -0.5998 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7565   -1.5211   -1.3677 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7149   -2.2911    0.2700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4962   -2.9346   -0.1006 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2608   -2.4374   -1.7863 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7781   -0.1196   -1.3042 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7497   -1.9680    0.1659 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0438   -2.3109   -2.0490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3400   -0.7465   -2.5127 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7457   -0.6521   -3.0067 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3740    1.0741   -2.4306 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1525   -0.3456   -1.7108 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7066    2.4290   -0.5183 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7215    1.7063   -1.4959 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0911   -0.2007    0.9600 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3573    1.4771    1.6715 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9458    2.0287    0.8817 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0748    0.7693    2.2186 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6678   -1.4725    1.6249 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9122   -1.4728    1.7555 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7733   -2.1786    0.2690 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0245    0.9976   -0.6122 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9897    1.6502    1.7144 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5394    0.0198    2.2411 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0760    1.5865    0.0670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6058    1.6391    1.7935 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3711   -1.9099    1.9032 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7879   -0.8301    2.8474 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3810   -2.0169    1.6700 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8845   -0.5849   -1.7127 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7896   -1.0106   -1.6660 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3244    0.6535   -2.3422 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6979   -0.8361   -3.0233 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7684   -1.1470    0.9355 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4915   -2.3651   -0.3409 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1069   -1.7151   -0.0582 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  1  0
  6  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 17 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  1
 21 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  1
  3 28  1  0
 28 29  1  0
 28 30  1  0
 26  8  1  0
 26 11  1  0
 23 12  1  0
 21 15  1  0
  1 31  1  0
  1 32  1  0
  1 33  1  0
  2 34  1  0
  2 35  1  0
  3 36  1  6
  4 37  1  0
  5 38  1  0
  6 39  1  1
  7 40  1  0
  7 41  1  0
  7 42  1  0
  8 43  1  6
  9 44  1  0
  9 45  1  0
 10 46  1  0
 10 47  1  0
 11 48  1  6
 12 49  1  1
 13 50  1  0
 13 51  1  0
 14 52  1  0
 16 53  1  0
 16 54  1  0
 17 55  1  1
 18 56  1  0
 19 57  1  0
 19 58  1  0
 20 59  1  0
 20 60  1  0
 22 61  1  0
 22 62  1  0
 22 63  1  0
 23 64  1  6
 24 65  1  0
 24 66  1  0
 25 67  1  0
 25 68  1  0
 27 69  1  0
 27 70  1  0
 27 71  1  0
 28 72  1  0
 29 73  1  0
 29 74  1  0
 29 75  1  0
 30 76  1  0
 30 77  1  0
 30 78  1  0
M  END

HEADER    PROTEIN                                 27-SEP-20   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   27-SEP-20         0                                  
HETATM    1  C   UNK     0    8666.6228667.865   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0    8662.6318665.538   0.000  0.00  0.00           C+0
HETATM    3  O   UNK     0    8658.6328661.672   0.000  0.00  0.00           O+0
HETATM    4  H   UNK     0    8663.9618663.232   0.000  0.00  0.00           H+0
HETATM    5  H   UNK     0    8665.2928665.538   0.000  0.00  0.00           H+0
HETATM    6  H   UNK     0    8666.6228663.232   0.000  0.00  0.00           H+0
HETATM    7  C   UNK     0    8661.2988664.759   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0    8659.9648663.989   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0    8659.9648662.449   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0    8661.2988661.679   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0    8662.6328662.449   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0    8662.6328663.989   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0    8665.2928667.086   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0    8663.9598666.316   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0    8663.9598664.775   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0    8665.2928664.006   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0    8663.9618661.679   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0    8665.2958662.449   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0    8666.6268666.315   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0    8666.6268664.775   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0    8668.0918664.300   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0    8668.9968665.545   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0    8668.0918666.791   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0    8668.0918668.331   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0    8669.4278669.101   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0    8670.7598668.331   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0    8672.0958669.101   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0    8673.4318668.331   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0    8674.7638669.101   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0    8673.4318666.791   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0    8672.0958670.641   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0    8673.4318671.411   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0    8666.7598669.101   0.000  0.00  0.00           C+0
HETATM   34  H   UNK     0    8669.4278667.561   0.000  0.00  0.00           H+0
CONECT    1   19                                                            
CONECT    2   12                                                            
CONECT    3    9                                                            
CONECT    4   15                                                            
CONECT    5   16                                                            
CONECT    6   20                                                            
CONECT    7    8   12                                                       
CONECT    8    7    9                                                       
CONECT    9    8   10    3                                                  
CONECT   10    9   11                                                       
CONECT   11   10   12   17                                                  
CONECT   12    7   11    2   15                                             
CONECT   13   14   19                                                       
CONECT   14   13   15                                                       
CONECT   15   14   16    4   12                                             
CONECT   16   15   18    5   20                                             
CONECT   17   18   11                                                       
CONECT   18   17   16                                                       
CONECT   19   20   23   13    1                                             
CONECT   20   19   21   16    6                                             
CONECT   21   20   22                                                       
CONECT   22   21   23                                                       
CONECT   23   24   34   19   22                                             
CONECT   24   23   25   33                                                  
CONECT   25   24   26                                                       
CONECT   26   25   27                                                       
CONECT   27   26   28   31                                                  
CONECT   28   27   29   30                                                  
CONECT   29   28                                                            
CONECT   30   28                                                            
CONECT   31   27   32                                                       
CONECT   32   31                                                            
CONECT   33   24                                                            
CONECT   34   23                                                            
MASTER        0    0    0    0    0    0    0    0   34    0   74    0
END

COMPND    HMDB0000937
HETATM    1  C1  UNL     1       7.939   1.684  -0.105  1.00  0.00           C  
HETATM    2  C2  UNL     1       6.555   1.572   0.402  1.00  0.00           C  
HETATM    3  C3  UNL     1       5.515   0.991  -0.469  1.00  0.00           C  
HETATM    4  C4  UNL     1       4.233   1.015   0.300  1.00  0.00           C  
HETATM    5  C5  UNL     1       3.413   0.020   0.407  1.00  0.00           C  
HETATM    6  C6  UNL     1       2.120   0.057   1.188  1.00  0.00           C  
HETATM    7  C7  UNL     1       2.001   1.233   2.069  1.00  0.00           C  
HETATM    8  C8  UNL     1       1.032  -0.219   0.238  1.00  0.00           C  
HETATM    9  C9  UNL     1       1.196  -1.579  -0.415  1.00  0.00           C  
HETATM   10  C10 UNL     1      -0.217  -2.077  -0.733  1.00  0.00           C  
HETATM   11  C11 UNL     1      -1.025  -0.852  -0.490  1.00  0.00           C  
HETATM   12  C12 UNL     1      -2.493  -1.033  -0.379  1.00  0.00           C  
HETATM   13  C13 UNL     1      -3.040  -1.227  -1.779  1.00  0.00           C  
HETATM   14  C14 UNL     1      -4.360  -0.631  -1.987  1.00  0.00           C  
HETATM   15  C15 UNL     1      -5.137  -0.070  -1.069  1.00  0.00           C  
HETATM   16  C16 UNL     1      -6.457   0.486  -1.473  1.00  0.00           C  
HETATM   17  C17 UNL     1      -7.076   1.366  -0.448  1.00  0.00           C  
HETATM   18  O1  UNL     1      -8.457   1.423  -0.590  1.00  0.00           O  
HETATM   19  C18 UNL     1      -6.780   0.862   0.954  1.00  0.00           C  
HETATM   20  C19 UNL     1      -5.288   1.004   1.143  1.00  0.00           C  
HETATM   21  C20 UNL     1      -4.611  -0.041   0.323  1.00  0.00           C  
HETATM   22  C21 UNL     1      -4.760  -1.380   1.020  1.00  0.00           C  
HETATM   23  C22 UNL     1      -3.123   0.199   0.181  1.00  0.00           C  
HETATM   24  C23 UNL     1      -2.473   0.725   1.411  1.00  0.00           C  
HETATM   25  C24 UNL     1      -1.018   1.021   1.015  1.00  0.00           C  
HETATM   26  C25 UNL     1      -0.363  -0.288   0.763  1.00  0.00           C  
HETATM   27  C26 UNL     1      -0.557  -1.297   1.850  1.00  0.00           C  
HETATM   28  C27 UNL     1       5.782  -0.318  -1.109  1.00  0.00           C  
HETATM   29  C28 UNL     1       6.960  -0.336  -2.034  1.00  0.00           C  
HETATM   30  C29 UNL     1       6.014  -1.428  -0.086  1.00  0.00           C  
HETATM   31  H1  UNL     1       8.495   0.762  -0.263  1.00  0.00           H  
HETATM   32  H2  UNL     1       8.028   2.432  -0.946  1.00  0.00           H  
HETATM   33  H3  UNL     1       8.519   2.213   0.721  1.00  0.00           H  
HETATM   34  H4  UNL     1       6.220   2.629   0.636  1.00  0.00           H  
HETATM   35  H5  UNL     1       6.586   1.102   1.430  1.00  0.00           H  
HETATM   36  H6  UNL     1       5.343   1.724  -1.308  1.00  0.00           H  
HETATM   37  H7  UNL     1       3.995   1.948   0.798  1.00  0.00           H  
HETATM   38  H8  UNL     1       3.620  -0.904  -0.076  1.00  0.00           H  
HETATM   39  H9  UNL     1       2.206  -0.827   1.867  1.00  0.00           H  
HETATM   40  H10 UNL     1       1.380   0.966   2.955  1.00  0.00           H  
HETATM   41  H11 UNL     1       3.027   1.419   2.512  1.00  0.00           H  
HETATM   42  H12 UNL     1       1.723   2.177   1.594  1.00  0.00           H  
HETATM   43  H13 UNL     1       1.023   0.512  -0.600  1.00  0.00           H  
HETATM   44  H14 UNL     1       1.756  -1.521  -1.368  1.00  0.00           H  
HETATM   45  H15 UNL     1       1.715  -2.291   0.270  1.00  0.00           H  
HETATM   46  H16 UNL     1      -0.496  -2.935  -0.101  1.00  0.00           H  
HETATM   47  H17 UNL     1      -0.261  -2.437  -1.786  1.00  0.00           H  
HETATM   48  H18 UNL     1      -0.778  -0.120  -1.304  1.00  0.00           H  
HETATM   49  H19 UNL     1      -2.750  -1.968   0.166  1.00  0.00           H  
HETATM   50  H20 UNL     1      -3.044  -2.311  -2.049  1.00  0.00           H  
HETATM   51  H21 UNL     1      -2.340  -0.746  -2.513  1.00  0.00           H  
HETATM   52  H22 UNL     1      -4.746  -0.652  -3.007  1.00  0.00           H  
HETATM   53  H23 UNL     1      -6.374   1.074  -2.431  1.00  0.00           H  
HETATM   54  H24 UNL     1      -7.153  -0.346  -1.711  1.00  0.00           H  
HETATM   55  H25 UNL     1      -6.707   2.429  -0.518  1.00  0.00           H  
HETATM   56  H26 UNL     1      -8.721   1.706  -1.496  1.00  0.00           H  
HETATM   57  H27 UNL     1      -7.091  -0.201   0.960  1.00  0.00           H  
HETATM   58  H28 UNL     1      -7.357   1.477   1.672  1.00  0.00           H  
HETATM   59  H29 UNL     1      -4.946   2.029   0.882  1.00  0.00           H  
HETATM   60  H30 UNL     1      -5.075   0.769   2.219  1.00  0.00           H  
HETATM   61  H31 UNL     1      -5.668  -1.473   1.625  1.00  0.00           H  
HETATM   62  H32 UNL     1      -3.912  -1.473   1.755  1.00  0.00           H  
HETATM   63  H33 UNL     1      -4.773  -2.179   0.269  1.00  0.00           H  
HETATM   64  H34 UNL     1      -3.025   0.998  -0.612  1.00  0.00           H  
HETATM   65  H35 UNL     1      -2.990   1.650   1.714  1.00  0.00           H  
HETATM   66  H36 UNL     1      -2.539   0.020   2.241  1.00  0.00           H  
HETATM   67  H37 UNL     1      -1.076   1.586   0.067  1.00  0.00           H  
HETATM   68  H38 UNL     1      -0.606   1.639   1.794  1.00  0.00           H  
HETATM   69  H39 UNL     1       0.371  -1.910   1.903  1.00  0.00           H  
HETATM   70  H40 UNL     1      -0.788  -0.830   2.847  1.00  0.00           H  
HETATM   71  H41 UNL     1      -1.381  -2.017   1.670  1.00  0.00           H  
HETATM   72  H42 UNL     1       4.884  -0.585  -1.713  1.00  0.00           H  
HETATM   73  H43 UNL     1       7.790  -1.011  -1.666  1.00  0.00           H  
HETATM   74  H44 UNL     1       7.324   0.653  -2.342  1.00  0.00           H  
HETATM   75  H45 UNL     1       6.698  -0.836  -3.023  1.00  0.00           H  
HETATM   76  H46 UNL     1       5.768  -1.147   0.936  1.00  0.00           H  
HETATM   77  H47 UNL     1       5.491  -2.365  -0.341  1.00  0.00           H  
HETATM   78  H48 UNL     1       7.107  -1.715  -0.058  1.00  0.00           H  
CONECT    1    2   31   32   33
CONECT    2    3   34   35
CONECT    3    4   28   36
CONECT    4    5    5   37
CONECT    5    6   38
CONECT    6    7    8   39
CONECT    7   40   41   42
CONECT    8    9   26   43
CONECT    9   10   44   45
CONECT   10   11   46   47
CONECT   11   12   26   48
CONECT   12   13   23   49
CONECT   13   14   50   51
CONECT   14   15   15   52
CONECT   15   16   21
CONECT   16   17   53   54
CONECT   17   18   19   55
CONECT   18   56
CONECT   19   20   57   58
CONECT   20   21   59   60
CONECT   21   22   23
CONECT   22   61   62   63
CONECT   23   24   64
CONECT   24   25   65   66
CONECT   25   26   67   68
CONECT   26   27
CONECT   27   69   70   71
CONECT   28   29   30   72
CONECT   29   73   74   75
CONECT   30   76   77   78
END

HMDB0000937
     RDKit          3D
Stigmasterol
 78 81  0  0  0  0  0  0  0  0999 V2000
    7.9389    1.6838   -0.1052 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5555    1.5718    0.4023 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5152    0.9911   -0.4689 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.2334    1.0149    0.3000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4128    0.0203    0.4068 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1200    0.0573    1.1882 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.0007    1.2328    2.0693 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0319   -0.2189    0.2382 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.1959   -1.5793   -0.4145 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2175   -2.0768   -0.7327 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0249   -0.8520   -0.4899 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.4932   -1.0330   -0.3795 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.0404   -1.2269   -1.7791 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3599   -0.6315   -1.9866 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1373   -0.0695   -1.0692 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4568    0.4861   -1.4727 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0764    1.3660   -0.4477 C   0  0  1  0  0  0  0  0  0  0  0  0
   -8.4572    1.4235   -0.5905 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7805    0.8618    0.9540 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2880    1.0037    1.1425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6108   -0.0406    0.3226 C   0  0  1  0  0  0  0  0  0  0  0  0
   -4.7603   -1.3796    1.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1228    0.1985    0.1807 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.4728    0.7251    1.4105 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0177    1.0215    1.0145 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3628   -0.2883    0.7627 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.5569   -1.2971    1.8499 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7818   -0.3180   -1.1090 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9602   -0.3362   -2.0336 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0140   -1.4282   -0.0862 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4948    0.7616   -0.2633 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0283    2.4323   -0.9455 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5192    2.2126    0.7212 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2199    2.6292    0.6363 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5862    1.1024    1.4298 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3434    1.7242   -1.3076 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9950    1.9484    0.7977 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6203   -0.9040   -0.0759 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2060   -0.8274    1.8671 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3802    0.9663    2.9555 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0273    1.4189    2.5124 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7225    2.1769    1.5940 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0231    0.5124   -0.5998 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7565   -1.5211   -1.3677 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7149   -2.2911    0.2700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4962   -2.9346   -0.1006 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2608   -2.4374   -1.7863 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7781   -0.1196   -1.3042 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7497   -1.9680    0.1659 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0438   -2.3109   -2.0490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3400   -0.7465   -2.5127 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7457   -0.6521   -3.0067 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3740    1.0741   -2.4306 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1525   -0.3456   -1.7108 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7066    2.4290   -0.5183 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7215    1.7063   -1.4959 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0911   -0.2007    0.9600 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3573    1.4771    1.6715 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9458    2.0287    0.8817 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0748    0.7693    2.2186 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6678   -1.4725    1.6249 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9122   -1.4728    1.7555 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7733   -2.1786    0.2690 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0245    0.9976   -0.6122 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9897    1.6502    1.7144 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5394    0.0198    2.2411 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0760    1.5865    0.0670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6058    1.6391    1.7935 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3711   -1.9099    1.9032 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7879   -0.8301    2.8474 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3810   -2.0169    1.6700 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8845   -0.5849   -1.7127 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7896   -1.0106   -1.6660 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3244    0.6535   -2.3422 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6979   -0.8361   -3.0233 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7684   -1.1470    0.9355 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4915   -2.3651   -0.3409 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1069   -1.7151   -0.0582 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  1  0
  6  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 17 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  1
 21 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  1
  3 28  1  0
 28 29  1  0
 28 30  1  0
 26  8  1  0
 26 11  1  0
 23 12  1  0
 21 15  1  0
  1 31  1  0
  1 32  1  0
  1 33  1  0
  2 34  1  0
  2 35  1  0
  3 36  1  6
  4 37  1  0
  5 38  1  0
  6 39  1  1
  7 40  1  0
  7 41  1  0
  7 42  1  0
  8 43  1  6
  9 44  1  0
  9 45  1  0
 10 46  1  0
 10 47  1  0
 11 48  1  6
 12 49  1  1
 13 50  1  0
 13 51  1  0
 14 52  1  0
 16 53  1  0
 16 54  1  0
 17 55  1  1
 18 56  1  0
 19 57  1  0
 19 58  1  0
 20 59  1  0
 20 60  1  0
 22 61  1  0
 22 62  1  0
 22 63  1  0
 23 64  1  6
 24 65  1  0
 24 66  1  0
 25 67  1  0
 25 68  1  0
 27 69  1  0
 27 70  1  0
 27 71  1  0
 28 72  1  0
 29 73  1  0
 29 74  1  0
 29 75  1  0
 30 76  1  0
 30 77  1  0
 30 78  1  0
M  END

View in JSmol View NMR Assignments

Synonyms

Value	Source
(3beta,22E)-Stigmasta-5,22-dien-3-ol	ChEBI
5,22-Cholestadien-24-ethyl-3beta-ol	ChEBI
beta-Stigmasterol	ChEBI
Phytosterol	ChEBI
Poriferasterol	ChEBI
Stigmasta-5,22-dien-3beta-ol	ChEBI
(3b,22E)-Stigmasta-5,22-dien-3-ol	Generator
(3Β,22E)-stigmasta-5,22-dien-3-ol	Generator
5,22-Cholestadien-24-ethyl-3b-ol	Generator
5,22-Cholestadien-24-ethyl-3β-ol	Generator
b-Stigmasterol	Generator
Β-stigmasterol	Generator
Stigmasta-5,22-dien-3b-ol	Generator
Stigmasta-5,22-dien-3β-ol	Generator
(24S)-5,22-Stigmastadien-3b-ol	HMDB
17-(4-Ethyl-1,5-dimethyl-hex-2-enyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol	HMDB
Stigmasta-5,22-dien-3-b-ol	HMDB
Stigmasta-5,22-dien-3-beta-ol	HMDB
Stigmasterin	HMDB
(24S)-24-Ethylcholesta-5,22-dien-3beta-ol	HMDB
(24S)-24-Ethylcholesta-5,22-dien-3β-ol	HMDB
(24S)-5,22-Stigmastadien-3beta-ol	HMDB
(24S)-5,22-Stigmastadien-3β-ol	HMDB
(24S)-Stigmast-5,22-dien-3beta-ol	HMDB
(24S)-Stigmast-5,22-dien-3β-ol	HMDB
24-Ethyl-5,22-cholestadien-3beta-ol	HMDB
24-Ethyl-5,22-cholestadien-3β-ol	HMDB
24beta-Ethyl-5,22-cholestadien-3beta-ol	HMDB
24Β-ethyl-5,22-cholestadien-3β-ol	HMDB
Stigmasta-5,22(e)-dien-3beta-ol	HMDB
Stigmasta-5,22(e)-dien-3β-ol	HMDB
delta5,22-Stigmastadien-3beta-ol	HMDB
delta5-Stigmasterol	HMDB
Δ5,22-stigmastadien-3β-ol	HMDB
Δ5-stigmasterol	HMDB
Stigmasterol	HMDB

Chemical Formula

C₂₉H₄₈O

Average Mass

412.7020 Da

Monoisotopic Mass

412.37052 Da

IUPAC Name

(1S,2R,5S,10S,11S,14R,15R)-14-[(2R,3E,5S)-5-ethyl-6-methylhept-3-en-2-yl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-7-en-5-ol

Traditional Name

(1S,2R,5S,10S,11S,14R,15R)-14-[(2R,3E,5S)-5-ethyl-6-methylhept-3-en-2-yl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-7-en-5-ol

CAS Registry Number

83-48-7

SMILES

[H]\C(=C(\[H])[C@@]([H])(C)[C@@]1([H])CC[C@@]2([H])[C@]3([H])CC=C4C[C@@]([H])(O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@@]([H])(CC)C(C)C

InChI Identifier

InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-10,19-21,23-27,30H,7,11-18H2,1-6H3/b9-8+/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1

InChI Key

HCXVJBMSMIARIN-PHZDYDNGSA-N

Experimental Spectra

Spectrum Type	Description	Depositor Email	Depositor Organization	Depositor	Deposition Date	View
HSQC NMR	[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, CDCl3, experimental)	bgnzk@missouri.edu	MU Metabolomics Center, University of Missouri, Columbia. MO, USA	Dr. Bharat Goel	2024-01-25	View Spectrum
HMBC NMR	[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, CDCl3, experimental)	bgnzk@missouri.edu	MU Metabolomics Center, University of Missouri, Columbia. MO, USA	Dr. Bharat Goel	2024-01-25	View Spectrum
COSY NMR	[¹H, ¹H] NMR Spectrum (2D, 600 MHz, CDCl3, experimental)	bgnzk@missouri.edu	MU Metabolomics Center, University of Missouri, Columbia. MO, USA	Dr. Bharat Goel	2024-01-25	View Spectrum
1D NMR	[¹³C, ] NMR Spectrum (2D, 201 MHz, CDCl3, experimental)	bgnzk@missouri.edu	MU Metabolomics Center, University of Missouri, Columbia. MO, USA	Dr. Bharat Goel	2024-01-25	View Spectrum
1D NMR	[¹H, ] NMR Spectrum (2D, 600 MHz, CDCl3, experimental)	bgnzk@missouri.edu	MU Metabolomics Center, University of Missouri, Columbia. MO, USA	Dr. Bharat Goel	2024-01-25	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600.133705802 MHz, CDCl₃, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 201.216488466 MHz, CDCl₃, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
2D NMR	[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, CDCl₃, experimental)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum

Predicted Spectra

Spectrum Type	Description	Depositor ID	Depositor Organization	Depositor	Deposition Date	View
1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 25 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 252 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 50 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 75 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 101 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 126 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 151 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 176 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 201 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 226 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Abelmoschus esculentus	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Abrus precatorius	KNApSAcK Database	22123792
Abutilon indicum	Plant	KNApSAcK
Acacia confusa	LOTUS Database	35616633
Acanthochlamys bracteata	LOTUS Database	35616633
Acanthopanax sessiliflorus	KNApSAcK Database	22123792
Acanthus ilicifolius	LOTUS Database	35616633
Acca sellowiana	LOTUS Database	35616633
Achillea ageratum	LOTUS Database	35616633
Achillea clypeolata	LOTUS Database	35616633
Achillea millefolium	KNApSAcK Database	22123792
Achillea santolina	LOTUS Database	35616633
Acmella paniculata	LOTUS Database	35616633
Acmella radicans	LOTUS Database	35616633
Aconitum septentrionale	LOTUS Database	35616633
Acorus calamus	LOTUS Database	35616633
Actinidia chinensis	FooDB	PHYTOHUB
Adenia cissampeloides	LOTUS Database	35616633
Adenosma caeruleum	KNApSAcK Database	22123792
Adina pilulifera	KNApSAcK Database	22123792
Aegiceras corniculatum	LOTUS Database	35616633
Aegle marmelos	LOTUS Database	35616633
Aesculus hippocastanum	LOTUS Database	35616633
Aframomum sceptrum	LOTUS Database	35616633
African marigold	LOTUS Database	35616633
Agaricus bisporus	FooDB	FooDB
Agave	FooDB	FooDB
Agave decipiens	LOTUS Database	35616633
Ageratina adenophora	Plant	KNApSAcK
Ageratina conyzoides	Plant	KNApSAcK
Ageratum conyzoides	KNApSAcK Database	22123792
Ageratum houstonianum	LOTUS Database	35616633
Aglaia lawii	LOTUS Database	35616633
Aglaia odorata	LOTUS Database	35616633
Aglaophenia pluma	LOTUS Database	35616633
Ajuga bracteosa	LOTUS Database	35616633
Ajuga parviflora	LOTUS Database	35616633
Ajuga taiwanensis	KNApSAcK Database	22123792
Akebia quinata	KNApSAcK Database	22123792
Alangium platanifolium	LOTUS Database	35616633
Aleurites fordii Hemsl.	KNApSAcK Database	22123792
Aleurites moluccanus	LOTUS Database	35616633
Aleuritopteris kuhnii	LOTUS Database	35616633
Alhagi sparsifolia	LOTUS Database	35616633
Alibertia macrophylla	LOTUS Database	35616633
Allagopappus dichotomus	LOTUS Database	35616633
Allanblackia floribunda	KNApSAcK Database	22123792
Allium ampeloprasum	FooDB	FooDB
Allium ascalonicum	FooDB	FooDB
Allium cepa	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Allium cepa L.	FooDB	PHYTOHUB
Allium fistulosum	FooDB	FooDB
Allium neapolitanum	LOTUS Database	35616633
Allium obliquum	Plant	KNApSAcK
Allium sativum	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Allium schoenoprasum	FooDB	FooDB
Allium tuberosum	FooDB	FooDB
Aloe vera	LOTUS Database	35616633
Aloysia triphylla	FooDB	FooDB
Alpinia mutica	LOTUS Database	35616633
Alpinia pinnanensis	LOTUS Database	35616633
Alpinia zerumbet	LOTUS Database	35616633
Alsophila spinulosa	LOTUS Database	35616633
Alstonia scholaris	KNApSAcK Database	22123792
Alstonia venenata	LOTUS Database	35616633
Alstroemeria aurantiaca	LOTUS Database	35616633
Alysicarpus monilifer	LOTUS Database	35616633
Amaranthus	FooDB	FooDB
Amaranthus caudatus	LOTUS Database	35616633
Amaranthus hypochondriacus	LOTUS Database	35616633
Ambrosia artemisioides	LOTUS Database	35616633
Ambrosia confertiflora	LOTUS Database	35616633
Ambrosia trifida	LOTUS Database	35616633
Amelanchier alnifolia	FooDB	FooDB
Ampelopsis japonica	LOTUS Database	35616633
Amphilectus fucorum	LOTUS Database	35616633
Anacardium occidentale	FooDB	PHYTOHUB
Anadenanthera colubrina	LOTUS Database	35616633
Ananas comosus	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Anastatica hierochuntica	LOTUS Database	35616633
Andira inermis	LOTUS Database	35616633
Andrographis paniculata	LOTUS Database	35616633
Anemone cernua	Plant	KNApSAcK
Anemone tomentosa	LOTUS Database	35616633
Anethum foeniculum	Plant	KNApSAcK
Anethum graveolens	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Angelica japonica	LOTUS Database	35616633
Angelica keiskei	FooDB	FooDB
Angelica pubescens	LOTUS Database	35616633
Angelica sinensis	KNApSAcK Database	22123792
Anisomeles indica	KNApSAcK Database	22123792
Annona cherimola	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Annona glabra	LOTUS Database	35616633
Annona muricata	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Annona purpurea	KNApSAcK Database	22123792
Annona reticulata	FooDB	FooDB
Annona squamosa	FooDB	FooDB
Anoectochilus koshunensis	LOTUS Database	35616633
Anthemis cotula	LOTUS Database	35616633
Anthriscus cerefolium	FooDB	FooDB
Aphanamixis polystachya	KNApSAcK Database	22123792
Aphanizomenon flos-aquae	LOTUS Database	35616633
Apis mellifera	LOTUS Database	35616633
Apium graveolens	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Apium graveolens var. dulce	FooDB	FooDB
Apium graveolens var. rapaceum	FooDB	PHYTOHUB
Apium graveolens var. secalinum	FooDB	FooDB
Aplysina fistularis	LOTUS Database	35616633
Arabidopsis thaliana	KNApSAcK Database	22123792
Arachis hypogaea	KNApSAcK Database	22123792
Archidendron chevalieri	LOTUS Database	35616633
Arctium lappa	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Arctotis arctotoides	LOTUS Database	35616633
Ardisia virens	LOTUS Database	35616633
Aristolochia heterophylla Hemsl	KNApSAcK Database	22123792
Aristolochia indica	LOTUS Database	35616633
Aristolochia kaempferi	LOTUS Database	35616633
Aristolochia manshuriensis	KNApSAcK Database	22123792
Aristolochia mollissima	KNApSAcK Database	22123792
Aristolochia zollingeriana	LOTUS Database	35616633
Armoracia rusticana	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Arnebia decumbens	LOTUS Database	35616633
Arnica acaulis	LOTUS Database	35616633
Arnica lanceolata	LOTUS Database	35616633
Arnica mollis	LOTUS Database	35616633
Arracacia nelsonii	LOTUS Database	35616633
Artabotrys hexapetalus	LOTUS Database	35616633
Artabotrys uncinatus	KNApSAcK Database	22123792
Artemisia annua	Plant	KNApSAcK
Artemisia annua L.	KNApSAcK Database	22123792
Artemisia argyi	KNApSAcK Database	22123792
Artemisia dracunculus	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Artemisia feddei	LOTUS Database	35616633
Artemisia giraldii	LOTUS Database	35616633
Artemisia herba-alba	LOTUS Database	35616633
Artemisia igniaria	LOTUS Database	35616633
Artemisia keiskeana	LOTUS Database	35616633
Artemisia monosperma	LOTUS Database	35616633
Artemisia sieversiana	KNApSAcK Database	22123792
Artemisia vulgaris	KNApSAcK Database	22123792
Artocarpus altilis	FooDB	FooDB
Artocarpus heterophyllus	FooDB	FooDB
Arundina chinensis	KNApSAcK Database	22123792
Arundo donax	KNApSAcK Database	22123792
Asclepias curassavica	LOTUS Database	35616633
Asclepias speciosa	LOTUS Database	35616633
Asparagus officinalis	Plant	KNApSAcK
Asphodelus albus	KNApSAcK Database	22123792
Aster tataricus	LOTUS Database	35616633
Asteracantha longifolia	-	KNApSAcK
Astragalus glycyphyllos	KNApSAcK Database	22123792
Atalantia buxifolia	KNApSAcK Database	22123792
Atractylodes lancea	LOTUS Database	35616633
Atractylodes macrocephala	LOTUS Database	35616633
Attalea speciosa	FooDB	FooDB
Auricularia auricula-judae	FooDB	FooDB
Auricularia polytricha	FooDB	FooDB
Austrobrickellia patens	LOTUS Database	35616633
Avena sativa	LOTUS Database	35616633
Avena sativa L.	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Averrhoa carambola	FooDB	FooDB
Axinella aruensis	LOTUS Database	35616633
Axinella cannabina	LOTUS Database	35616633
Azadirachta indica	KNApSAcK Database	22123792
Azolla nilotica	LOTUS Database	35616633
Baccharis neaei	LOTUS Database	35616633
Baccharis salicifolia	LOTUS Database	35616633
Baccharoides anthelmintica	LOTUS Database	35616633
Bahia pringlei	LOTUS Database	35616633
Banisteriopsis caapi	LOTUS Database	35616633
Barringtonia racemosa	KNApSAcK Database	22123792
Basella alba	FooDB	FooDB
Bauhinia candicans	KNApSAcK Database	22123792
Bauhinia forficata	LOTUS Database	35616633
Bauhinia purpurea	LOTUS Database	35616633
Bauhinia roxburghiana	LOTUS Database	35616633
Bauhinia vahlii L.	KNApSAcK Database	22123792
Begonia heracleifolia	LOTUS Database	35616633
Begonia nantoensis	KNApSAcK Database	22123792
Benincasa hispida	FooDB	FooDB
Berberis vulgaris	LOTUS Database	35616633
Bertholletia excelsa	FooDB	PHYTOHUB
Beta vulgaris	FooDB	FooDB
Beta vulgaris ssp. cicla	FooDB	FooDB
Bidens pilosa	LOTUS Database	35616633
Bidens subalternans	LOTUS Database	35616633
Blainvillea acmella	LOTUS Database	35616633
Blepharispermum zanguebaricum	LOTUS Database	35616633
Blumea arfakiana	LOTUS Database	35616633
Blutaparon portulacoides	KNApSAcK Database	22123792
Boehmeria holosericea	KNApSAcK Database	22123792
Boehmeria tricuspis	KNApSAcK Database	22123792
Boerhavia diffusa	LOTUS Database	35616633
Bombyx mori	LOTUS Database	35616633
Bonnetia paniculata	LOTUS Database	35616633
Borago officinalis	FooDB	FooDB
Botryocladia leptopoda	LOTUS Database	35616633
Brassica alboglabra	FooDB	FooDB
Brassica juncea	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Brassica napus	FooDB	FooDB
Brassica napus var. napus	FooDB	USDA
Brassica oleracea	FooDB	PHYTOHUB
Brassica oleracea var. botrytis	FooDB	PHYTOHUB
Brassica oleracea var. capitata	FooDB	FooDB
Brassica oleracea var. gemmifera	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Brassica oleracea var. gongylodes	FooDB	FooDB
Brassica oleracea var. italica	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Brassica oleracea var. sabauda	FooDB	FooDB
Brassica oleracea var. viridis	FooDB	FooDB
Brassica rapa	FooDB	FooDB
Brassica rapa ssp. chinensis	FooDB	FooDB
Brassica rapa var. pekinensis	FooDB	FooDB
Brassica rapa var. rapa	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Brassica ruvo	FooDB	FooDB
Bridelia ferruginea	LOTUS Database	35616633
Bridelia ovata	LOTUS Database	35616633
Brosimum acutifolium	KNApSAcK Database	22123792
Brosimum alicastrum	FooDB	FooDB
Bruguiera gymnorhiza	LOTUS Database	35616633
Bryopteris filicina	LOTUS Database	35616633
Buddleja cordata	LOTUS Database	35616633
Buddleja lindleyana	LOTUS Database	35616633
Buddleja madagascariensis	KNApSAcK Database	22123792
Bulbophyllum protractum	LOTUS Database	35616633
Bupleurum chinense	KNApSAcK Database	22123792
Butea monosperma	KNApSAcK Database	22123792
Byrsonima crassifolia	FooDB	FooDB
Cacalia auriculata	LOTUS Database	35616633
Caesalpinia decapetala	KNApSAcK Database	22123792
Caesalpinia minax	KNApSAcK Database	22123792
Cajanus cajan	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Calendula officinalis	Plant	KNApSAcK
Calendula officinalis L.	KNApSAcK Database	22123792
Callicarpa pilosissima	KNApSAcK Database	22123792
Callilepis salicifolia	LOTUS Database	35616633
Calophyllum gracilipes	LOTUS Database	35616633
Calophyllum inophyllum	LOTUS Database	35616633
Calophyllum macrocarpum	LOTUS Database	35616633
Calophyllum soulattri	LOTUS Database	35616633
Calophyllum teysmannii	LOTUS Database	35616633
Calotropis procera	LOTUS Database	35616633
Calycanthus floridus	KNApSAcK Database	22123792
Calyptocarpus vialis	LOTUS Database	35616633
Campylopus richardii	LOTUS Database	35616633
Campylospermum sulcatum	LOTUS Database	35616633
Canarium ovatum	FooDB	FooDB
Canavalia ensiformis	LOTUS Database	35616633
Cannabis sativa	CannabisDB	Not Available
Cantharellus cibarius	FooDB	USDA
Capparis spinosa	FooDB	FooDB
Capsicum annuum	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Capsicum annuum L.	FooDB	FooDB
Capsicum annuum var. annuum	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Capsicum chinense	FooDB	FooDB
Capsicum pubescens	FooDB	FooDB
Caragana microphylla	KNApSAcK Database	22123792
Carica papaya L.	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Carissa macrocarpa	FooDB	FooDB
Carpesium abrotanoides	KNApSAcK Database	22123792
Carthamus mareoticus	LOTUS Database	35616633
Carthamus tinctorius	FooDB	FooDB
Carum carvi	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Carya	FooDB	FooDB
Carya illinoinensis	FooDB	PHYTOHUB
Cassia fistula	LOTUS Database	35616633
Castanea	FooDB	FooDB
Castanea crenata	FooDB	FooDB
Castanea mollissima	FooDB	FooDB
Castanea sativa	FooDB	FooDB
Catharanthus roseus	LOTUS Database	35616633
Cedrela montana	LOTUS Database	35616633
Cedrela odorata	LOTUS Database	35616633
Celosia argentea	LOTUS Database	35616633
Celosia cristata	LOTUS Database	35616633
Celtis laevigata	KNApSAcK Database	22123792
Centaurea aspera	LOTUS Database	35616633
Centaurea calcitrapa	LOTUS Database	35616633
Centaurea iberica	LOTUS Database	35616633
Centaurea langei	LOTUS Database	35616633
Centaurea stoebe	LOTUS Database	35616633
Centaurium quadrifolium	LOTUS Database	35616633
Centipeda minima	KNApSAcK Database	22123792
Centrapalus pauciflorus	LOTUS Database	35616633
Centrosema pubescens	KNApSAcK Database	22123792
Ceratonia siliqua	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Ceriops tagal	LOTUS Database	35616633
Chaetanthera chilensis	LOTUS Database	35616633
Chamaecyparis formosensis	KNApSAcK Database	22123792
Chamaemelum nobile	FooDB	FooDB
Chamerion angustifolium	FooDB	FooDB
Changium smyrnioides	-	KNApSAcK
Chara australis	LOTUS Database	35616633
Cheiropleuria bicuspis	LOTUS Database	35616633
Chelonanthus albus	LOTUS Database	35616633
Chengiopanax sciadophylloides	LOTUS Database	35616633
Chenopodium album	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Chenopodium ficifolium	LOTUS Database	35616633
Chenopodium quinoa	FooDB	FooDB
Chlorella spp.	Plant	KNApSAcK
Chloromorum toxicum	-	KNApSAcK
Chlorophytum arundinaceum	Plant	KNApSAcK
Choisya ternata	LOTUS Database	35616633
Chorisia insignis	-	KNApSAcK
Chorisia speciosa	-	KNApSAcK
Chromolaena odorata	LOTUS Database	35616633
Chrysanthemum coronarium	FooDB	FooDB
Chrysobalanus icaco	LOTUS Database	35616633
Chrysolaena platensis	LOTUS Database	35616633
Chrysolaena propinqua	LOTUS Database	35616633
Chrysotila carterae	LOTUS Database	35616633
Cicer arietinum	KNApSAcK Database	22123792
Cichorium endivia	FooDB	FooDB
Cichorium intybus	KNApSAcK Database	22123792
Cichorium spinosum	LOTUS Database	35616633
Cinachyrella schulzei	LOTUS Database	35616633
Cineraria parvifolia	LOTUS Database	35616633
Cinnamomum	FooDB	FooDB
Cinnamomum aromaticum	FooDB	FooDB
Cinnamomum kotoense	LOTUS Database	35616633
Cinnamomum subavenium	KNApSAcK Database	22123792
Cinnamomum tenuifolium	LOTUS Database	35616633
Cinnamomum verum	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Cinnamosma madagascariensis	KNApSAcK Database	22123792
Cipangopaludina japonica	LOTUS Database	35616633
Cirsium	FooDB	FooDB
Cirsium arvense	LOTUS Database	35616633
Cirsium japonicum	KNApSAcK Database	22123792
Citropsis articulata	LOTUS Database	35616633
Citrullus lanatus	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Citrus ×limon (L.) Burm. f. (pro sp.)	FooDB	FooDB
Citrus aurantiifolia	FooDB	FooDB
Citrus latifolia	FooDB	FooDB
Citrus limon	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Citrus maxima	FooDB	FooDB
Citrus medica	LOTUS Database	35616633
Citrus paradisi	FooDB	FooDB
Citrus reticulata	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Citrus sinensis	LOTUS Database	35616633
Citrus tankan	KNApSAcK Database	22123792
Citrus trifoliata	LOTUS Database	35616633
Citrus X sinensis (L.) Osbeck (pro. sp.)	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Cleidion spiciflorum (Burm. f.) Merr.	KNApSAcK Database	22123792
Clematis drummondii	LOTUS Database	35616633
Cleome amblyocarpa	LOTUS Database	35616633
Clerodendron cyrtophyllum	KNApSAcK Database	22123792
Clerodendron neutens	KNApSAcK Database	22123792
Clerodendron serratum	KNApSAcK Database	22123792
Clerodendrum chinense	LOTUS Database	35616633
Clerodendrum fragrans	LOTUS Database	35616633
Clerodendrum infortunatum	LOTUS Database	35616633
Clerodendrum wallichii	LOTUS Database	35616633
Climacoptera lanata	LOTUS Database	35616633
Clinopodium umbrosum	LOTUS Database	35616633
Cliona celata	LOTUS Database	35616633
Cocos nucifera	KNApSAcK Database	22123792
Codium decorticatum	LOTUS Database	35616633
Codonopsis pilosula	KNApSAcK Database	22123792
Codonopsis pilosula subsp. tangshen	Plant	KNApSAcK
Codonopsis pilosula var.modesta	KNApSAcK Database	22123792
Codonopsis subglobosa	KNApSAcK Database	22123792
Codonopsis tangshen	KNApSAcK Database	22123792
Coffea arabica L.	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Coffea canephora	FooDB	PHYTOHUB
Coix lacryma-jobi	KNApSAcK Database	22123792
Colocasia esculenta	FooDB	FooDB
Conium maculatum	LOTUS Database	35616633
Conocephalum supradecompositum	LOTUS Database	35616633
Convolvulus arvensis	LOTUS Database	35616633
Conyza aegyptiaca	LOTUS Database	35616633
Conyza aegyptica	KNApSAcK Database	22123792
Corbicula fluminea	LOTUS Database	35616633
Corchorus olitorius	FooDB	FooDB
Coreopsis mutica	LOTUS Database	35616633
Coriandrum sativum L.	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Coriaria intermedia	LOTUS Database	35616633
Corydalis remota	KNApSAcK Database	22123792
Corylus	FooDB	USDA
Corylus avellana	KNApSAcK Database	22123792
Corylus maxima	KNApSAcK Database	22123792
Coscinium fenestratum	LOTUS Database	35616633
Costus tonkinensis	LOTUS Database	35616633
Couepia polyandra	KNApSAcK Database	22123792
Coussarea brevicaulis	LOTUS Database	35616633
Crataegus pinnatifida	LOTUS Database	35616633
Crateva religiosa	FooDB	FooDB
Cratystylis conocephala	LOTUS Database	35616633
Cremanthodium arnicoides	LOTUS Database	35616633
Crepis capillaris (L.) Wallr.	LOTUS Database	35616633
Cribricellina cribraria	LOTUS Database	35616633
Crinum asiaticum	LOTUS Database	35616633
Crocus sativus	FooDB	FooDB
Croton cajucara	LOTUS Database	35616633
Croton sublyratus	LOTUS Database	35616633
Croton urucurana	LOTUS Database	35616633
Croton urucurana Baill.	KNApSAcK Database	22123792
Croton zambesicus	KNApSAcK Database	22123792
Cucumis melo	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Cucumis metuliferus	FooDB	FooDB
Cucumis sativus	LOTUS Database	35616633
Cucumis sativus L.	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Cucurbita	FooDB	FooDB
Cucurbita maxima	FooDB	USDA
Cucurbita moschata	FooDB	FooDB
Cullen corylifolium	Plant	KNApSAcK
Cuminum cyminum	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Cuphea appendiculata	LOTUS Database	35616633
Curculigo orchioides	LOTUS Database	35616633
Curcuma aromatica	Plant	KNApSAcK
Curcuma longa	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Curcuma ochrorhiza	LOTUS Database	35616633
Cuscuta campestris	LOTUS Database	35616633
Cuscuta reflexa	LOTUS Database	35616633
Cussonia bancoensis	KNApSAcK Database	22123792
Cussonia zimmermannii	LOTUS Database	35616633
Cyanara scolymus	-	KNApSAcK
Cyanthillium cinereum	LOTUS Database	35616633
Cydonia oblonga	FooDB	FooDB
Cymbopogon citratus	FooDB	USDA
Cymbopogon parkeri	LOTUS Database	35616633
Cymodocea nodosa	LOTUS Database	35616633
Cymodocea serrulata	KNApSAcK Database	22123792
Cynara cardunculus	FooDB	FooDB
Cynara humilis	LOTUS Database	35616633
Cynara scolymus	FooDB	FooDB
Cynara sibthorpiana	LOTUS Database	35616633
Cyperus conglomeratus	LOTUS Database	35616633
Cystoseira barbata	LOTUS Database	35616633
Dalbergia monetaria	LOTUS Database	35616633
Dalbergia sissoo	LOTUS Database	35616633
Dalbergia volubilis	LOTUS Database	35616633
Daphne oleoides	LOTUS Database	35616633
Daucus carota	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Daucus carota ssp. sativus	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Debregeasia salicifolia	LOTUS Database	35616633
Dendrobium cariniferum	LOTUS Database	35616633
Dendrobium loddigesii	LOTUS Database	35616633
Dendrobium thyrsiflorum	LOTUS Database	35616633
Dendroviguiera quinqueradiata	LOTUS Database	35616633
Desmos chinensis	LOTUS Database	35616633
Desmostachya bipinnata	LOTUS Database	35616633
Dictanopteris pedata	-	KNApSAcK
Dicteostelium discoideum	-	KNApSAcK
Digitalis lanata	LOTUS Database	35616633
Digitalis purpurea	LOTUS Database	35616633
Dimerostemma brasilianum	LOTUS Database	35616633
Dimetia scandens	LOTUS Database	35616633
Dimocarpus longan	FooDB	FooDB
Dioscorea	FooDB	FooDB
Dioscorea batatas	KNApSAcK Database	22123792
Dioscorea communis	Plant	KNApSAcK
Dioscorea convolvulacea	LOTUS Database	35616633
Dioscorea cyphocarpa	KNApSAcK Database	22123792
Dioscorea deltoidea	LOTUS Database	35616633
Dioscorea dregeana	LOTUS Database	35616633
Dioscorea membranacea	LOTUS Database	35616633
Dioscorea parviflora	LOTUS Database	35616633
Dioscorea pentaphylla	FooDB	FooDB
Dioscorea polystachya	LOTUS Database	35616633
Diospyros	FooDB	FooDB
Diospyros buxifolia	KNApSAcK Database	22123792
Diospyros castanea	KNApSAcK Database	22123792
Diospyros cauliflora	KNApSAcK Database	22123792
Diospyros crassiflora	LOTUS Database	35616633
Diospyros curranii	KNApSAcK Database	22123792
Diospyros diepenhorstii	KNApSAcK Database	22123792
Diospyros ebenum	KNApSAcK Database	22123792
Diospyros evena	KNApSAcK Database	22123792
Diospyros kaki	KNApSAcK Database	22123792
Diospyros maritima	LOTUS Database	35616633
Diospyros mollis	KNApSAcK Database	22123792
Diospyros montana	KNApSAcK Database	22123792
Diospyros morrisiana	KNApSAcK Database	22123792
Diospyros rhodocalyx	KNApSAcK Database	22123792
Diospyros sanza-minika	KNApSAcK Database	22123792
Diospyros variegata	KNApSAcK Database	22123792
Diospyros virginiana	FooDB	FooDB
Diploclisia glaucescens	LOTUS Database	35616633
Diplopterygium glaucum	LOTUS Database	35616633
Dodonaea viscosa	KNApSAcK Database	22123792
Dolichos lablab	KNApSAcK Database	22123792
Dorstenia brasiliensis	LOTUS Database	35616633
Dracaena cinnabari	LOTUS Database	35616633
Dragmacidon lunaecharta	LOTUS Database	35616633
Drimia indica	LOTUS Database	35616633
Drynaria fortunei	KNApSAcK Database	22123792
Drypetes gossweileri	LOTUS Database	35616633
Drypetes inaequalis	KNApSAcK Database	22123792
Drypetes indica	LOTUS Database	35616633
Dugaldia hoopesii	LOTUS Database	35616633
Duhaldea cappa	Plant	KNApSAcK
Dumortiera hirsuta	LOTUS Database	35616633
Durio zibethinus	FooDB	FooDB
Duttaphrynus melanostictus	LOTUS Database	35616633
Dynamena pumila	-	KNApSAcK
Dysidea avara	LOTUS Database	35616633
Dysidea fragilis	LOTUS Database	35616633
Dysphania ambrosioides	FooDB	FooDB
Dysphania graveolens	LOTUS Database	35616633
Echinodorus grandiflorus	LOTUS Database	35616633
Echinometra lucunter	LOTUS Database	35616633
Eclipta alba	LOTUS Database	35616633
Eclipta prostrata	LOTUS Database	35616633
Ectyoplasia ferox	LOTUS Database	35616633
Elaeis	FooDB	FooDB
Eleocharis acutangula	LOTUS Database	35616633
Eleocharis dulcis	FooDB	FooDB
Elephantopus mollis	LOTUS Database	35616633
Elephantopus scaber	KNApSAcK Database	22123792
Elettaria cardamomum	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Eleutherococcus senticosus	LOTUS Database	35616633
Eleutherococcus senticosus Rupr.and Maxim.	KNApSAcK Database	22123792
Eleutherococcus sessiliflorus	LOTUS Database	35616633
Eleutherococcus trichodon	LOTUS Database	35616633
Eleutherococcus trifoliatus	LOTUS Database	35616633
Embelia schimperi	KNApSAcK Database	22123792
Emilia sonchifolia	LOTUS Database	35616633
Empetrum nigrum	FooDB	FooDB
Enhalus acoroides	KNApSAcK Database	22123792
Entandrophragma angolense	LOTUS Database	35616633
Enteromorpha linza	LOTUS Database	35616633
Ephedra equisetina	LOTUS Database	35616633
Eragrostis tef	FooDB	FooDB
Eremanthus crotonoides	LOTUS Database	35616633
Eremanthus veadeiroensis	LOTUS Database	35616633
Erigeron canadensis	LOTUS Database	35616633
Eriobotrya japonica	FooDB	FooDB
Eruca vesicaria subsp. Sativa	FooDB	FooDB
Erucaria microcarpa	LOTUS Database	35616633
Ervatamia coronaria	LOTUS Database	35616633
Eryngium foetidum	LOTUS Database	35616633
Erythrina arborescens Roxb.	KNApSAcK Database	22123792
Erythrina indica	KNApSAcK Database	22123792
Erythrina mildbraedii	LOTUS Database	35616633
Erythrina sigmoidea	LOTUS Database	35616633
Erythrina stricta	LOTUS Database	35616633
Erythrina variegata	Plant	KNApSAcK
Erythrophleum fordii	LOTUS Database	35616633
Espeletia killipii	LOTUS Database	35616633
Eucalyptus tereticornis	LOTUS Database	35616633
Eugenia javanica	FooDB	FooDB
Eugenia uniflora	FooDB	FooDB
Euonymus japonicus	LOTUS Database	35616633
Eupatorium altissimum	LOTUS Database	35616633
Eupatorium cannabinum	LOTUS Database	35616633
Eupatorium macrocephalum Lee.	KNApSAcK Database	22123792
Eupatorium quadrangulare	LOTUS Database	35616633
Eupatorium serotinum	LOTUS Database	35616633
Euphorbia bivonae	LOTUS Database	35616633
Euphorbia ebracteolata	LOTUS Database	35616633
Euphorbia fischeriana	LOTUS Database	35616633
Euphorbia indica	KNApSAcK Database	22123792
Euphorbia lathyris	KNApSAcK Database	22123792
Euphorbia plumerioides	LOTUS Database	35616633
Euphorbia prostrata	LOTUS Database	35616633
Euphorbia pseudocactus	LOTUS Database	35616633
Euphorbia sessiliflora	LOTUS Database	35616633
Euphorbia sessiliflora Roxb.	KNApSAcK Database	22123792
Euphorbia tirucalli	LOTUS Database	35616633
Euphoria longan	-	KNApSAcK
Euphrasia officinalis	LOTUS Database	35616633
Eurycoma longifolia	LOTUS Database	35616633
Eutrema japonicum	FooDB	FooDB
Eutreptia viridis	LOTUS Database	35616633
Evolvulus nummularius	LOTUS Database	35616633
Eysenhardtia polystachya	KNApSAcK Database	22123792
Fagara heitzii	KNApSAcK Database	22123792
Fagara tessmannii Engl.	KNApSAcK Database	22123792
Fagonia cretica	LOTUS Database	35616633
Fagopyrum esculentum	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Fagopyrum tataricum	FooDB	FooDB
Fagus	FooDB	FooDB
Farfugium hiberniflorum	LOTUS Database	35616633
Fatsia japonica	LOTUS Database	35616633
Feijoa sellowiana	KNApSAcK Database	22123792
Ferula diversivittata	KNApSAcK Database	22123792
Ferula szowitsiana	KNApSAcK Database	22123792
Ferula szowitziana	Plant	KNApSAcK
Festuca argentina	LOTUS Database	35616633
Fibraurea tinctoria	LOTUS Database	35616633
Ficus carica	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Ficus hirta	KNApSAcK Database	22123792
Ficus pandurata	LOTUS Database	35616633
Ficus polita	LOTUS Database	35616633
Ficus pumila	LOTUS Database	35616633
Ficus septica	KNApSAcK Database	22123792
Ficus virens	LOTUS Database	35616633
Flammulina velutipes	FooDB	FooDB
Foeniculum vulgare	KNApSAcK Database	22123792
Fragaria x ananassa	FooDB	FooDB
Frullania brasiliensis	KNApSAcK Database	22123792
Frullania falciloba	LOTUS Database	35616633
Frullania monocera	KNApSAcK Database	22123792
Fumaria indica	LOTUS Database	35616633
Galeana pratensis	LOTUS Database	35616633
Galega officinalis	LOTUS Database	35616633
Galphimia glauca	LOTUS Database	35616633
Garcinia acuminata	LOTUS Database	35616633
Garcinia afzelii	Plant	KNApSAcK
Garcinia afzelii ENGL.	KNApSAcK Database	22123792
Garcinia bancana	LOTUS Database	35616633
Garcinia bancana MIQ	KNApSAcK Database	22123792
Garcinia mangostana	FooDB	FooDB
Garcinia multiflora	KNApSAcK Database	22123792
Garcinia scortechinii	LOTUS Database	35616633
Garcinia speciosa	LOTUS Database	35616633
Garcinia staudtii	LOTUS Database	35616633
Gaultheria borneensis	LOTUS Database	35616633
Gaultheria itoana	LOTUS Database	35616633
Gaylussacia baccata	FooDB	FooDB
Geigeria burkei	LOTUS Database	35616633
Gentiana algida	LOTUS Database	35616633
Gentiana lutea	Plant	KNApSAcK
Gentiana lutea L.	KNApSAcK Database	22123792
Gentiana macrophylla	LOTUS Database	35616633
Ginkgo biloba	KNApSAcK Database	22123792
Gladiolus italicus	LOTUS Database	35616633
Gleditsea sinensis	-	KNApSAcK
Gleditsia sinensis	LOTUS Database	35616633
Gleditsia sinensis LAM.	KNApSAcK Database	22123792
Glehnia littoralis	KNApSAcK Database	22123792
Gloriosa superba	LOTUS Database	35616633
Glossogyne tenuifolia	LOTUS Database	35616633
Glycine max	KNApSAcK Database	22123792
Glycyrrhiza glabra	LOTUS Database	35616633
Gomphrena celosioides	KNApSAcK Database	22123792
Goniophlebium mengtzeense	LOTUS Database	35616633
Goniothalamus amuyon	KNApSAcK Database	22123792
Goniothalamus borneensis	LOTUS Database	35616633
Goniothalamus cardiopetalus	LOTUS Database	35616633
Gonospermum canariense	LOTUS Database	35616633
Gonospermum fruticosum	LOTUS Database	35616633
Gonospermum gomerae	KNApSAcK Database	22123792
Gossypium	FooDB	FooDB
Gossypium hirsutum	LOTUS Database	35616633
Grewia bicolor Juss.	LOTUS Database	35616633
Grewia tenax	LOTUS Database	35616633
Grifola frondosa	FooDB	USDA
Gryllotalpa orientalis	LOTUS Database	35616633
Guarea guidonia	LOTUS Database	35616633
Guarea rhophalocarpa	KNApSAcK Database	22123792
Guatteria blepharophylla	LOTUS Database	35616633
Guilandina bonduc	LOTUS Database	35616633
Gundelia tournefortii	LOTUS Database	35616633
Gustavia longifolia	LOTUS Database	35616633
Gymnanthemum myrianthum	LOTUS Database	35616633
Gymnotheca involucrata	LOTUS Database	35616633
Gynochthodes umbellata	Plant	KNApSAcK
Gynura japonica	LOTUS Database	35616633
Gynura segetum	KNApSAcK Database	22123792
Halodule uninervis	KNApSAcK Database	22123792
Halophila ovalis	KNApSAcK Database	22123792
Halophila ovata	KNApSAcK Database	22123792
Halophila spinulosa	KNApSAcK Database	22123792
Haloxylon salicornicum	LOTUS Database	35616633
Haplocarpha lyrata	LOTUS Database	35616633
Haplopappus foliosus	LOTUS Database	35616633
Haplophyllum bucharicum	LOTUS Database	35616633
Harpullia pendula	LOTUS Database	35616633
Harrisonia abyssinica	LOTUS Database	35616633
Hebanthe eriantha	LOTUS Database	35616633
Hedychium coronarium	LOTUS Database	35616633
Hedyotis auricularia	LOTUS Database	35616633
Hedyotis corymbosa	KNApSAcK Database	22123792
Hedysarum alpinum	FooDB	FooDB
Helianthus annuus	LOTUS Database	35616633
Helianthus annuus L.	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Helianthus porteri	LOTUS Database	35616633
Helianthus radula	LOTUS Database	35616633
Helianthus simulans	LOTUS Database	35616633
Helianthus tuberosus	FooDB	FooDB
Helichrysum arenarium	LOTUS Database	35616633
Heliotropium ellipticum	LOTUS Database	35616633
Heliotropium indicum	KNApSAcK Database	22123792
Heliotropium marifolium	Plant	KNApSAcK
Hellenia speciosa	LOTUS Database	35616633
Heptapleurum rhododendrifolium	LOTUS Database	35616633
Heracleum wallichii	KNApSAcK Database	22123792
Herpetospermum caudigerum WALL	KNApSAcK Database	22123792
Hertia cheirifolia	KNApSAcK Database	22123792
Heterothalamus spartioides	KNApSAcK Database	22123792
Hibiscus cannabinus	LOTUS Database	35616633
Hibiscus sabbariffa	FooDB	FooDB
Hibiscus sabdariffa	LOTUS Database	35616633
Hibiscus taiwanensis	KNApSAcK Database	22123792
Hippophae rhamnoides	KNApSAcK Database	22123792
Hordeum vulgare	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Hordeum vulgare L.cv Mammut	KNApSAcK Database	22123792
Hoslundia opposita	LOTUS Database	35616633
Hydnophytum formicarum	LOTUS Database	35616633
Hydrodictyon reticulatum	LOTUS Database	35616633
Hygrophila auriculata	LOTUS Database	35616633
Hylocereus undatus	LOTUS Database	35616633
Hymenopappus scabiosaeus	LOTUS Database	35616633
Hymenothrix glandulopubescens	LOTUS Database	35616633
Hypericum beanii	KNApSAcK Database	22123792
Hypericum brasiliense	LOTUS Database	35616633
Hypericum carinatum	KNApSAcK Database	22123792
Hypericum laricifolium	LOTUS Database	35616633
Hypholoma fasciculare	LOTUS Database	35616633
Hyptis capitata	LOTUS Database	35616633
Hyssopus officinalis L.	FooDB	FooDB
Ifloga spicata	LOTUS Database	35616633
Ilex aquifolium	LOTUS Database	35616633
Illicium verum	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Indocypraea montana	LOTUS Database	35616633
Inula anatolica	KNApSAcK Database	22123792
Inula cappa	KNApSAcK Database	22123792
Inula salsoloides	LOTUS Database	35616633
Iostephane heterophylla	LOTUS Database	35616633
Ipheion uniflorum	LOTUS Database	35616633
Ipomoea aquatica	FooDB	FooDB
Ipomoea batatas	FooDB	FooDB
Iresine diffusa	LOTUS Database	35616633
Iris pallida	LOTUS Database	35616633
Iris sofarana	LOTUS Database	35616633
Iris soforana	KNApSAcK Database	22123792
Isodon lophanthoides	LOTUS Database	35616633
Isodon scoparius	LOTUS Database	35616633
Isodon serra	LOTUS Database	35616633
Isodon trichocarpus	LOTUS Database	35616633
Isodon umbrosus	LOTUS Database	35616633
Isodon yuennanensis	LOTUS Database	35616633
Isolona congolana	LOTUS Database	35616633
Isolona maitlandii	LOTUS Database	35616633
Isotachis japonica	LOTUS Database	35616633
Ixeridium gracile	LOTUS Database	35616633
Ixora coccinea	LOTUS Database	35616633
Jacobaea arnautorum	LOTUS Database	35616633
Juglans	FooDB	USDA
Juglans ailanthifolia	FooDB	FooDB
Juglans cinerea	FooDB	FooDB
Juglans nigra L.	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Juglans regia	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Jungia polita	LOTUS Database	35616633
Justicia heterocarpa T.ANDERS	KNApSAcK Database	22123792
Kaempferia rotunda	LOTUS Database	35616633
Kalanchoe marmorata	LOTUS Database	35616633
Kalanchoe petitiana	LOTUS Database	35616633
Kalanchoe pinnata	LOTUS Database	35616633
Kalanchoe spathulata	KNApSAcK Database	22123792
Kallstroemia maxima	LOTUS Database	35616633
Kaunia lasiophthalma	LOTUS Database	35616633
Khaya anthotheca	LOTUS Database	35616633
Khaya ivorensis	KNApSAcK Database	22123792
Khaya senegalensis	LOTUS Database	35616633
Khaya senegalensis L.	KNApSAcK Database	22123792
Krameria tomentosa	LOTUS Database	35616633
Lablab purpureus	Plant	KNApSAcK
Lactuca indica	KNApSAcK Database	22123792
Lactuca sativa	FooDB	15986496
Lagenaria breviflora	LOTUS Database	35616633
Lagenaria siceraria	FooDB	FooDB
Laggera alata	LOTUS Database	35616633
Lamium amplexicaule	LOTUS Database	35616633
Lantana camara	LOTUS Database	35616633
Lantana ukambensis	LOTUS Database	35616633
Lanurocerasus officinalis	-	KNApSAcK
Laserpitium siler	LOTUS Database	35616633
Lasiolaena morii	LOTUS Database	35616633
Lathyrus sativus	FooDB	FooDB
Launaea arborescens	KNApSAcK Database	22123792
Laurencia obtusa	-	KNApSAcK
Laurus nobilis L.	FooDB	FooDB
Lawsonia inermis	LOTUS Database	35616633
Lecanthus peduncularis	LOTUS Database	35616633
Lemna aequinoctialis	LOTUS Database	35616633
Lens culinaris	FooDB	USDA
Lentinus edodes	FooDB	USDA
Leonurus persicus	KNApSAcK Database	22123792
Lepechinia caulescens	LOTUS Database	35616633
Lepidium meyenii	LOTUS Database	35616633
Lepidium sativum	FooDB	FooDB
Lepidozia reptans	LOTUS Database	35616633
Lessingia glandulifera	LOTUS Database	35616633
Lessingianthus linearis	LOTUS Database	35616633
Leucas aspera	LOTUS Database	35616633
Leucas cephalotes	LOTUS Database	35616633
Leucas cephalotes SPRENG.	KNApSAcK Database	22123792
Levisticum officinale	FooDB	FooDB
Liabum floribundum	LOTUS Database	35616633
Liabum solidagineum	LOTUS Database	35616633
Libanotis intermedia	-	KNApSAcK
Licaria triandra	LOTUS Database	35616633
Ligularia atroviolacea	LOTUS Database	35616633
Ligularia duciformis	LOTUS Database	35616633
Ligularia nelumbifolia	LOTUS Database	35616633
Ligularia tongolensis	LOTUS Database	35616633
Ligularia veitchiana	LOTUS Database	35616633
Ligusticum porteri	LOTUS Database	35616633
Lilium brownii var.viridulum	KNApSAcK Database	22123792
Limecola balthica	LOTUS Database	35616633
Limonia acidissima	LOTUS Database	35616633
Limonium axillare	LOTUS Database	35616633
Lindera obtusiloba	KNApSAcK Database	22123792
Linum scabrellum	Plant	KNApSAcK
Linum usitatissimum	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Liriodendron tulipifera	LOTUS Database	35616633
Litchi chinensis	FooDB	FooDB
Litsea glutinosa	LOTUS Database	35616633
Litsea umbellata	LOTUS Database	35616633
Lobatiriccardia lobata	LOTUS Database	35616633
Lonchocarpus minimiflorus	LOTUS Database	35616633
Lonicera japonica	KNApSAcK Database	22123792
Lophanthera lactescens	LOTUS Database	35616633
Loranthus falcatus	KNApSAcK Database	22123792
Loxocalyx urticifolius	LOTUS Database	35616633
Luffa aegyptiaca	FooDB	FooDB
Lupinus	FooDB	FooDB
Lupinus albus	FooDB	FooDB
Luvunga sarmentosa (Bl.) Kurz.	KNApSAcK Database	22123792
Luxemburgia octandra	LOTUS Database	35616633
Lychnophora ericoides	LOTUS Database	35616633
Lycium chinense	KNApSAcK Database	22123792
Lycopodium cernuum	KNApSAcK Database	22123792
Lygodium flexuosum	KNApSAcK Database	22123792
Lysimachia fordiana	LOTUS Database	35616633
Lysimachia heterogenea	LOTUS Database	35616633
Lysimachia patungensis	LOTUS Database	35616633
Macadamia	FooDB	USDA
Macadamia tetraphylla	FooDB	USDA
Machilus japonica	LOTUS Database	35616633
Machilus zuihoensis	LOTUS Database	35616633
Maclura pomifera	LOTUS Database	35616633
Madhuca longifolia	LOTUS Database	35616633
Madia sativa	LOTUS Database	35616633
Maesopsis eminii	LOTUS Database	35616633
Magnolia kachirachirai	LOTUS Database	35616633
Malpighia emarginata	FooDB	FooDB
Malus	FooDB	FooDB
Malus pumila	FooDB	PHYTOHUB
Malva parviflora	Plant	KNApSAcK
Mammea americana	FooDB	FooDB
Mangifera indica	FooDB	FooDB
Manihot esculenta	KNApSAcK Database	22123792
Manilkara zapota	FooDB	FooDB
Mannia fragrans	LOTUS Database	35616633
Maranta arundinacea	FooDB	FooDB
Marchantia polymorpha	LOTUS Database	35616633
Markhamia platycalyx	LOTUS Database	35616633
Marsypianthes chamaedrys	LOTUS Database	35616633
Mastigophora diclados	LOTUS Database	35616633
Matricaria chamomilla	LOTUS Database	35616633
Matricaria recutita	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Matteuccia struthiopteris	FooDB	FooDB
Medicago sativa	KNApSAcK Database	22123792
Melia azedarach	LOTUS Database	35616633
Melicope latifolia	LOTUS Database	35616633
Melicope semecarpifolia	KNApSAcK Database	22123792
Melicope triphylla	LOTUS Database	35616633
Melissa officinalis L.	FooDB	FooDB
Melochia tomentosa	LOTUS Database	35616633
Melodorum fruticosum	LOTUS Database	35616633
Mentha	FooDB	FooDB
Mentha aquatica	FooDB	FooDB
Mentha arvensis	FooDB	FooDB
Mentha spicata	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Mentha x piperita	FooDB	FooDB
Mespilus germanica	FooDB	FooDB
Mesua ferrea	LOTUS Database	35616633
Metrodorea nigra	LOTUS Database	35616633
Metroxylon sagu	FooDB	FooDB
Michelia compressa	LOTUS Database	35616633
Microglossa pyrifolia	LOTUS Database	35616633
Microtropis fokienensis	LOTUS Database	35616633
Mikania campanulata	LOTUS Database	35616633
Mikania cordata	LOTUS Database	35616633
Mikania glomerata	LOTUS Database	35616633
Mikania goyazensis	LOTUS Database	35616633
Mikania micrantha	LOTUS Database	35616633
Mikania triangularis	LOTUS Database	35616633
Mirabilis jalapa	LOTUS Database	35616633
Mitragyna inermis	Plant	KNApSAcK
Mitragyna rotundifolia	Plant	KNApSAcK
Mitragyna speciosa	Plant	KNApSAcK
Mitragyna stipulosa	Plant	KNApSAcK
Moghania strobilifera	-	KNApSAcK
Mollinedia gilgiana	LOTUS Database	35616633
Momordica charantia	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Monocyclanthus vignei	LOTUS Database	35616633
Montanoa leucantha	LOTUS Database	35616633
Montanoa tomentosa	LOTUS Database	35616633
Monteverdia ilicifolia	LOTUS Database	35616633
Morchellaceae	FooDB	USDA
Morella rubra	FooDB	FooDB
Morinda citrifolia	LOTUS Database	35616633
Morinda officinalis	Plant	KNApSAcK
Morinda umbellata	KNApSAcK Database	22123792
Moringa oleifera	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Morus	FooDB	FooDB
Morus alba	LOTUS Database	35616633
Morus nigra	FooDB	FooDB
Mosla dianthera	LOTUS Database	35616633
Mulinia lateralis	LOTUS Database	35616633
Murraya koenigii	LOTUS Database	35616633
Murraya paniculata	LOTUS Database	35616633
Musa acuminata	FooDB	PHYTOHUB
Musa paradisiaca	LOTUS Database	35616633
Musa x paradisiaca	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Musella lasiocarpa	LOTUS Database	35616633
Mussaenda pubescens	KNApSAcK Database	22123792
Myrica	FooDB	FooDB
Myristica fragrans	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Nauclea diderrichii	LOTUS Database	35616633
Nectandra amazonum	LOTUS Database	35616633
Nelumbo	FooDB	FooDB
Nelumbo nucifera	FooDB	FooDB
Neobeguea mahafalensis	LOTUS Database	35616633
Neocheiropteris fortunei	Plant	KNApSAcK
Neolamarckia cadamba	LOTUS Database	35616633
Neolitsea acuminatissima	KNApSAcK Database	22123792
Nephelium lappaceum	FooDB	FooDB
Nerium oleander	LOTUS Database	35616633
Nervilia aragoana	LOTUS Database	35616633
Nervilia plicata	LOTUS Database	35616633
Nicandra physaloides	KNApSAcK Database	22123792
Nicotiana benthamiana	KNApSAcK Database	22123792
Nicotiana paniculata	LOTUS Database	35616633
Nicotiana tabacum	KNApSAcK Database	22123792
Nigella sativa	Plant	KNApSAcK
Nostoc carneum	LOTUS Database	35616633
Nuphar lutea	FooDB	USDA
Ochromonas danica	LOTUS Database	35616633
Ochromonas malhamensis	-	KNApSAcK
Ocimum basilicum	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Ocimum gratissimum	LOTUS Database	35616633
Ocimum spicatum	KNApSAcK Database	22123792
Ocimum tenuiflorum	LOTUS Database	35616633
Ocotea corymbosa	LOTUS Database	35616633
Oenanthe javanica	LOTUS Database	35616633
Oenothera biennis	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Oldenlandia diffusa	KNApSAcK Database	22123792
Olea europaea	FooDB	FooDB
Ongokea gore	LOTUS Database	35616633
Onoseris onoseroides	LOTUS Database	35616633
Ophiocordyceps sinensis	LOTUS Database	35616633
Ophioplocus japonicus	LOTUS Database	35616633
Ophiopogon japonicus	KNApSAcK Database	22123792
Opuntia	FooDB	FooDB
Opuntia cochenillifera	FooDB	FooDB
Opuntia macrorhiza	FooDB	FooDB
Oriciopsis glaberrima ENGL.	KNApSAcK Database	22123792
Origanum majorana	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Origanum onites	FooDB	FooDB
Origanum vulgare	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Origanum X majoricum	FooDB	FooDB
Ornithopus sativus	LOTUS Database	35616633
Oryza coarctata	LOTUS Database	35616633
Oryza rufipogon	FooDB	FooDB
Oryza sativa	KNApSAcK Database	22123792
Osmanthus armatus	LOTUS Database	35616633
Osteospermum corymbosum	LOTUS Database	35616633
Otostegia integrifolia	LOTUS Database	35616633
Ouratea sulcata	KNApSAcK Database	22123792
Ozothamnus retusus	LOTUS Database	35616633
Pachyrhizus erosus	FooDB	FooDB
Pachysandra terminalis	LOTUS Database	35616633
Padina gymnospora	LOTUS Database	35616633
Paederia foetida	KNApSAcK Database	22123792
Palhinhaea cernua	Plant	KNApSAcK
Paliurus hemsleyanus	LOTUS Database	35616633
Panax ginseng	KNApSAcK Database	22123792
Panax pseudo-ginseng var.notoginseng	KNApSAcK Database	22123792
Panax quinquefolius	LOTUS Database	35616633
Pangium edule	FooDB	FooDB
Panicum miliaceum	FooDB	FooDB
Papaver	FooDB	PHYTOHUB
Papaver rhoeas	LOTUS Database	35616633
Papaver somniferum	KNApSAcK Database	22123792
Paris polyphylla	LOTUS Database	35616633
Paspalum scrobiculatum	LOTUS Database	35616633
Passiflora edulis	FooDB	FooDB
Pastinaca sativa	FooDB	FooDB
Pediomelum esculentum	FooDB	FooDB
Pennisetum americanum	LOTUS Database	35616633
Pentaphalangium solomonse Warb.	KNApSAcK Database	22123792
Peperomia blanda	LOTUS Database	35616633
Peperomia leptostachya	LOTUS Database	35616633
Peperomia pellucida	LOTUS Database	35616633
Perideridia oregana	FooDB	FooDB
Perilla frutescens	LOTUS Database	35616633
Perilla frutescens var.acuta	KNApSAcK Database	22123792
Perilla frutescens var.crispa	KNApSAcK Database	22123792
Periploca nigrescens	LOTUS Database	35616633
Peristrophe japonica	LOTUS Database	35616633
Persea americana	FooDB	PHYTOHUB
Persicaria hydropiper	LOTUS Database	35616633
Persicaria pubescens	LOTUS Database	35616633
Persicaria viscosa	Plant	KNApSAcK
Petasites japonicus	FooDB	FooDB
Petersianthus macrocarpus	LOTUS Database	35616633
Petroselinum crispum	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Petrosia ficiformis	LOTUS Database	35616633
Petrosia weinbergi	LOTUS Database	35616633
Phagnalon purpurascens	LOTUS Database	35616633
Phaseolus coccineus	FooDB	FooDB
Phaseolus lunatus	FooDB	FooDB
Phaseolus vulgaris	KNApSAcK Database	22123792
Phoenix canariensis	LOTUS Database	35616633
Phoenix dactylifera	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Photinia melanocarpa	FooDB	FooDB
Phyllanthus flexuosus	LOTUS Database	35616633
Phyllanthus fraternus	Plant	KNApSAcK
Phyllanthus sellowianus	LOTUS Database	35616633
Phyllanthus urinaria	LOTUS Database	35616633
Phyllostachys edulis	FooDB	FooDB
Physalis	FooDB	FooDB
Physalis coztomatl	LOTUS Database	35616633
Physalis philadelphica var. immaculata	FooDB	FooDB
Physalis sordida	LOTUS Database	35616633
Physarum flavicomum	Amoebozoa	KNApSAcK
Physostigma venenosum	KNApSAcK Database	22123792
Phytolacca americana	FooDB	FooDB
Picradeniopsis schaffneri	LOTUS Database	35616633
Picramnia teapensis	LOTUS Database	35616633
Pimenta dioica	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Pimpinella anisum	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Pinus	FooDB	PHYTOHUB
Pinus edulis	FooDB	FooDB
Piper aduncum	LOTUS Database	35616633
Piper dilatatum	LOTUS Database	35616633
Piper guineense	LOTUS Database	35616633
Piper kadsura	KNApSAcK Database	22123792
Piper lolot	LOTUS Database	35616633
Piper methysticum Forst.f.	KNApSAcK Database	22123792
Piper nigrum	LOTUS Database	35616633
Piper nigrum L.	KNApSAcK Database	22123792
Piper pedicellatum	LOTUS Database	35616633
Piper philippinum	KNApSAcK Database	22123792
Piper sarmentosum	LOTUS Database	35616633
Pisonia aculeata	LOTUS Database	35616633
Pistacia vera	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Pisum sativum	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Pittosporum illicioides	LOTUS Database	35616633
Plagiochasma rupestre	LOTUS Database	35616633
Plagiochila asplenioides	LOTUS Database	35616633
Plagiochila pulcherrima	LOTUS Database	35616633
Planaltoa lychnophoroides	LOTUS Database	35616633
Planchonia careya	LOTUS Database	35616633
Plantago asiatica	KNApSAcK Database	22123792
Plantago major	KNApSAcK Database	22123792
Platycladus orientalis	LOTUS Database	35616633
Platypodium elegans	LOTUS Database	35616633
Pleiospermium alatum	LOTUS Database	35616633
Pleopeltis polypodioides	LOTUS Database	35616633
Pleurotus ostreatus	FooDB	USDA
Pleurozia gigantea	LOTUS Database	35616633
Pluchea carolinensis	LOTUS Database	35616633
Pluchea chingoyo	LOTUS Database	35616633
Pluchea dioscorides	LOTUS Database	35616633
Pluchea indica	LOTUS Database	35616633
Pluchea indica Less.	KNApSAcK Database	22123792
Pluchea sagittalis	LOTUS Database	35616633
Plumbago indica	LOTUS Database	35616633
Plumbago zeylanica	Plant	KNApSAcK
Pneumocystis carinii	LOTUS Database	35616633
Podachaenium eminens	LOTUS Database	35616633
Polyalthia longifolia var.pendula	KNApSAcK Database	22123792
Polygala arillata	KNApSAcK Database	22123792
Polygala caudata	KNApSAcK Database	22123792
Polygonum alpinum	FooDB	FooDB
Polypodium formosanum	LOTUS Database	35616633
Polyscias bracteata	LOTUS Database	35616633
Pongamia pinnata	LOTUS Database	35616633
Porella platyphylla	LOTUS Database	35616633
Porella swartziana	LOTUS Database	35616633
Portulaca oleracea	FooDB	FooDB
Posidonia oceanica	KNApSAcK Database	22123792
Potamogeton nodosus	LOTUS Database	35616633
Potentilla fruticosa	LOTUS Database	35616633
Pourouma guianensis	LOTUS Database	35616633
Pouteria sapota	FooDB	FooDB
Prosopis glandulosa	LOTUS Database	35616633
Prosopis spicigera	KNApSAcK Database	22123792
Protium heptaphyllum	LOTUS Database	35616633
Prunus armeniaca	FooDB	PHYTOHUB
Prunus avium	FooDB	FooDB
Prunus avium L.	FooDB	FooDB
Prunus cerasoides	LOTUS Database	35616633
Prunus cerasus	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Prunus domestica	FooDB	PHYTOHUB
Prunus dulcis	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Prunus laurocerasus	LOTUS Database	35616633
Prunus persica	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Prunus persica var. nucipersica	FooDB	FooDB
Prunus persica var. persica	FooDB	FooDB
Prunus tomentosa	FooDB	FooDB
Prunus virginiana	FooDB	FooDB
Prunus zippeliana	LOTUS Database	35616633
Psacalium megaphyllum	LOTUS Database	35616633
Pseudelephantopus spicatus	LOTUS Database	35616633
Pseudodictamnus undulatus	LOTUS Database	35616633
Pseudognaphalium gaudichaudianum	LOTUS Database	35616633
Pseudognaphalium viscosum	LOTUS Database	35616633
Psidium cattleianum	FooDB	FooDB
Psidium guajava	FooDB	FooDB
Psophocarpus tetragonolobus	FooDB	FooDB
Psoralea corylifolia	KNApSAcK Database	22123792
Psychotria serpens	KNApSAcK Database	22123792
Pteleopsis hylodendron	KNApSAcK Database	22123792
Pterocarpus marsupium	LOTUS Database	35616633
Pterocarpus santalinus	KNApSAcK Database	22123792
Pterodon apraricioi	KNApSAcK Database	22123792
Ptilidium ciliare var. pulcherrimum	LOTUS Database	35616633
Pueraria montana	LOTUS Database	35616633
Pueraria tuberosa	KNApSAcK Database	22123792
Pulicaria arabica	LOTUS Database	35616633
Pulicaria canariensis	KNApSAcK Database	22123792
Pulicaria dysenterica	LOTUS Database	35616633
Pulicaria paludosa	LOTUS Database	35616633
Pulicaria scabra	LOTUS Database	35616633
Pulsatilla cernua	KNApSAcK Database	22123792
Punica granatum	KNApSAcK Database	22123792
Pyrus communis	FooDB	FooDB
Pyrus pyrifolia	FooDB	FooDB
Quercus	FooDB	FooDB
Quercus rotundifolia	LOTUS Database	35616633
Ranunculus sceleratus	LOTUS Database	35616633
Ranunculus silerifolius	LOTUS Database	35616633
Raphanus sativus	KNApSAcK Database	22123792
Raphanus sativus var. longipinnatus	FooDB	FooDB
Raphanus sativus var. sativus	FooDB	FooDB
Raputia praetermissa	LOTUS Database	35616633
Ratibida columnaris	LOTUS Database	35616633
Rauvolfia mattfeldiana	LOTUS Database	35616633
Rauvolfia serpentina	LOTUS Database	35616633
Rauvolfia vomitoria	LOTUS Database	35616633
Ravenia spectabilis	LOTUS Database	35616633
Reboulia hemisphaerica	LOTUS Database	35616633
Rehmannia glutinosa	KNApSAcK Database	22123792
Rheum rhabarbarum	FooDB	FooDB
Rhinacanthus nasutus	LOTUS Database	35616633
Rhinella arenarum	LOTUS Database	35616633
Rhizophora apiculata	LOTUS Database	35616633
Rhodopentas bussei	LOTUS Database	35616633
Rhynchosia minima	LOTUS Database	35616633
Ribes aureum	FooDB	FooDB
Ribes glandulosum	FooDB	FooDB
Ribes nigrum	FooDB	PHYTOHUB
Ribes rubrum	FooDB	PHYTOHUB
Ribes uva-crispa	FooDB	FooDB
Ricciocarpos natans	LOTUS Database	35616633
Richardia grandiflora	LOTUS Database	35616633
Robinsonecio gerberifolius	KNApSAcK Database	22123792
Rohdea chinensis	Plant	KNApSAcK
Rolandra fruticosa	LOTUS Database	35616633
Rosa	FooDB	FooDB
Rosa sericea	LOTUS Database	35616633
Rubia wallichiana	LOTUS Database	35616633
Rubia wallichiana DECNE	KNApSAcK Database	22123792
Rubia yunnanensis	KNApSAcK Database	22123792
Rubus arcticus	FooDB	FooDB
Rubus chamaemorus	FooDB	FooDB
Rubus crataegifolius	LOTUS Database	35616633
Rubus fruticosus	LOTUS Database	35616633
Rubus idaeus	FooDB	FooDB
Rubus occidentalis	FooDB	FooDB
Rubus rosa	LOTUS Database	35616633
Rubus spectabilis	FooDB	FooDB
Rudbeckia mollis	LOTUS Database	35616633
Rudbeckia subtomentosa	LOTUS Database	35616633
Rudgea jasminoides	LOTUS Database	35616633
Ruellia tuberosa	KNApSAcK Database	22123792
Rumex	FooDB	FooDB
Rumex acetosa	FooDB	FooDB
Rumex articus	FooDB	FooDB
Ruppia maritima	KNApSAcK Database	22123792
Ruprechtia tangarana	LOTUS Database	35616633
Ruscus aculeatus	LOTUS Database	35616633
Ruscus hypoglossum	LOTUS Database	35616633
Ruttnera lamellosa	LOTUS Database	35616633
Saccharum sinensis	KNApSAcK Database	22123792
Sagittaria latifolia	FooDB	FooDB
Salix pulchra	FooDB	FooDB
Salmea scandens	LOTUS Database	35616633
Salpa thompsoni	LOTUS Database	35616633
Salsola collina	LOTUS Database	35616633
Salvia aegyptiaca	KNApSAcK Database	22123792
Salvia amplexicaulis	LOTUS Database	35616633
Salvia bucharica	LOTUS Database	35616633
Salvia elegans	FooDB	FooDB
Salvia fruticosa	LOTUS Database	35616633
Salvia glutinosa	LOTUS Database	35616633
Salvia hispanica	FooDB	FooDB
Salvia limbata	LOTUS Database	35616633
Salvia miltiorrhiza	LOTUS Database	35616633
Salvia officinalis	KNApSAcK Database	22123792
Salvia rosmarinus	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Salvia tchihatcheffii	LOTUS Database	35616633
Sambucus canadensis	KNApSAcK Database	22123792
Sambucus javanica	LOTUS Database	35616633
Sambucus nigra	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Sambucus nigra L.	FooDB	FooDB
Sambucus nigra.	KNApSAcK Database	22123792
Sanicula epipactis	LOTUS Database	35616633
Sansevieria ehrenbergii	LOTUS Database	35616633
Santalum album	KNApSAcK Database	22123792
Sapium stylare	LOTUS Database	35616633
Sargassum filipendula	LOTUS Database	35616633
Satureja hortensis L.	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Satureja montana	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Saussurea controversa	LOTUS Database	35616633
Saussurea costus	Plant	KNApSAcK
Saussurea japonica	LOTUS Database	35616633
Saussurea lappa	KNApSAcK Database	22123792
Saussurea muliensis	KNApSAcK Database	22123792
Scapania undulata	LOTUS Database	35616633
Schefflera arboricola	Plant	KNApSAcK
Schistochila glaucescens	KNApSAcK Database	22123792
Schkuhria schkuhrioides	LOTUS Database	35616633
Schleichera trijuga	KNApSAcK Database	22123792
Sciadotenia toxifera	LOTUS Database	35616633
Scleropyrum pentandrum	LOTUS Database	35616633
Scleropyrum wallichianum	KNApSAcK Database	22123792
Scorzonera hispanica	FooDB	FooDB
Scutellaria baicalensis	KNApSAcK Database	22123792
Sebertia acuminata	KNApSAcK Database	22123792
Secale cereale	FooDB	FooDB
Sechium edule	FooDB	FooDB
Sekanama sanguinea	LOTUS Database	35616633
Senecio glutinosus	LOTUS Database	35616633
Senecio madagascariensis	LOTUS Database	35616633
Senecio superandinus	LOTUS Database	35616633
Senecio viravira	KNApSAcK Database	22123792
Senecio viscosus	LOTUS Database	35616633
Senna italica	LOTUS Database	35616633
Senna lindheimeriana	LOTUS Database	35616633
Senna obtusifolia	LOTUS Database	35616633
Senna petersiana	LOTUS Database	35616633
Senna singueana	LOTUS Database	35616633
Sesamum indicum	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Sesamum radiatum	LOTUS Database	35616633
Sesbania bispinosa	FooDB	FooDB
Setaria italica	LOTUS Database	35616633
Sida rhombifolia	Plant	KNApSAcK
Sideritis argosphacelus var. spicata	KNApSAcK Database	22123792
Sideritis candicans	LOTUS Database	35616633
Sideritis candicans var.eriocephala	KNApSAcK Database	22123792
Sideritis cretica	LOTUS Database	35616633
Sideritis discolor	KNApSAcK Database	22123792
Sideritis kuegleriana	KNApSAcK Database	22123792
Sideritis lotsyi	KNApSAcK Database	22123792
Sideritis lotsyi var. mascaensis	KNApSAcK Database	22123792
Sideritis soluta	KNApSAcK Database	22123792
Sideritis taurica	LOTUS Database	35616633
Sideritis tenoi	KNApSAcK Database	22123792
Sigesbeckia orientalis	-	KNApSAcK
Sinapis alba	FooDB	FooDB
Sinomenium acutum	KNApSAcK Database	22123792
Sisymbrium	FooDB	FooDB
Smallanthus maculatus	LOTUS Database	35616633
Smyrnium galaticum	LOTUS Database	35616633
Smyrnium perfoliatum	LOTUS Database	35616633
Solanum aethiopicum	LOTUS Database	35616633
Solanum anguivi	LOTUS Database	35616633
Solanum argentinum	LOTUS Database	35616633
Solanum arundo	LOTUS Database	35616633
Solanum aviculare	LOTUS Database	35616633
Solanum chacoense Bitt.	KNApSAcK Database	22123792
Solanum lanceolatum	LOTUS Database	35616633
Solanum lycopersicum	FooDB	PHYTOHUB
Solanum lycopersicum var. cerasiforme	FooDB	FooDB
Solanum lycopersicum var. lycopersicum	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Solanum mammosum	LOTUS Database	35616633
Solanum melongena	FooDB	FooDB
Solanum palitans	LOTUS Database	35616633
Solanum pseudocapsicum	LOTUS Database	35616633
Solanum ptychanthum	LOTUS Database	35616633
Solanum quitoense	FooDB	FooDB
Solanum torvum	LOTUS Database	35616633
Solanum tuberosum	KNApSAcK Database	22123792
Solanum virginianum	LOTUS Database	35616633
Solidago canadensis	LOTUS Database	35616633
Sorbus aucuparia	FooDB	FooDB
Sorghum bicolor	FooDB	FooDB
Sphaeranthus suaveolens	LOTUS Database	35616633
Sphagneticola trilobata	LOTUS Database	35616633
Spinacia oleracea	FooDB	PHYTOHUB
Spiracantha cornifolia	LOTUS Database	35616633
Spiraea formosana	KNApSAcK Database	22123792
Stangeria eriopus	LOTUS Database	35616633
Stauntonia hexaphylla	LOTUS Database	35616633
Stellaria dichotoma	LOTUS Database	35616633
Stemodia foliosa	KNApSAcK Database	22123792
Stemona collinsae	KNApSAcK Database	22123792
Stemona collinsiae	Plant	KNApSAcK
Stemona curtisii	LOTUS Database	35616633
Sterculia balanghas	LOTUS Database	35616633
Stevia connata	LOTUS Database	35616633
Stevia monardifolia	LOTUS Database	35616633
Stevia porphyrea	KNApSAcK Database	22123792
Stevia serrata	LOTUS Database	35616633
Stilpnopappus tomentosus	LOTUS Database	35616633
Strobilanthes japonicus	Plant	KNApSAcK
Strychnos dolychothyrsa	KNApSAcK Database	22123792
Strychnos potatorum	KNApSAcK Database	22123792
Suaeda aegyptiaca	LOTUS Database	35616633
Swartzia apetala	LOTUS Database	35616633
Swartzia arborescens	LOTUS Database	35616633
Symphonia globulifera	LOTUS Database	35616633
Symphoricarpos albus	LOTUS Database	35616633
Symphyotrichum subulatum	LOTUS Database	35616633
Synsepalum dulcificum	LOTUS Database	35616633
Syzygium aromaticum	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Syzygium cumini	FooDB	FooDB
Syzygium jambos	FooDB	FooDB
Tabernaemontana catharinensis	LOTUS Database	35616633
Tabernaemontana markgrafiana	LOTUS Database	35616633
Tabernaemontana pachysiphon	LOTUS Database	35616633
Tadehagi triquetrum	LOTUS Database	35616633
Taiwanofungus camphoratus	Fungi	KNApSAcK
Tamarindus indica	FooDB	FooDB
Tamarix aphylla	LOTUS Database	35616633
Tamus communis L.	KNApSAcK Database	22123792
Tanacetum parthenium	LOTUS Database	35616633
Tanacetum sinaicum	LOTUS Database	35616633
Tanacetum vulgare	LOTUS Database	35616633
Tanaecium bilabiatum	LOTUS Database	35616633
Taraxacum formosanum	KNApSAcK Database	22123792
Taraxacum officinale	KNApSAcK Database	22123792
Tarlmounia elliptica	LOTUS Database	35616633
Taxus cuspidata	KNApSAcK Database	22123792
Tedania anhelans	LOTUS Database	35616633
Telekia speciosa	LOTUS Database	35616633
Tephrosia angustissima	LOTUS Database	35616633
Tephrosia leiocarpa	LOTUS Database	35616633
Tephrosia uniflora	LOTUS Database	35616633
Terminalia hylodendron	Plant	KNApSAcK
Terminalia superba	KNApSAcK Database	22123792
Ternstroemia gymnanthera	KNApSAcK Database	22123792
Tetragonia tetragonioides	FooDB	FooDB
Teucrium chamaedrys	LOTUS Database	35616633
Teucrium divaricatum	LOTUS Database	35616633
Thalassia hemprichii	KNApSAcK Database	22123792
Thalia multiflora	LOTUS Database	35616633
Thelesperma	FooDB	FooDB
Theobroma cacao	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Theobroma speciosum	LOTUS Database	35616633
Thomandersia laurifolia	LOTUS Database	35616633
Thymus pulegioides	FooDB	FooDB
Thymus vulgaris	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Tilia cordata	FooDB	FooDB
Tilia L.	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Tillandsia brachycaulos	LOTUS Database	35616633
Tillandsia fasciculata	LOTUS Database	35616633
Tillandsia streptocarpa	LOTUS Database	35616633
Tinospora crispa	Plant	KNApSAcK
Tithonia longiradiata	LOTUS Database	35616633
Todaroa aurea	LOTUS Database	35616633
Toddalia asiatica	LOTUS Database	35616633
Tolpis webbii	LOTUS Database	35616633
Toona ciliata	LOTUS Database	35616633
Toona sinensis	KNApSAcK Database	22123792
Tornabea scutellifera	LOTUS Database	35616633
Tovomita brasiliensis	KNApSAcK Database	22123792
Tragopogon orientalis	LOTUS Database	35616633
Tragopogon porrifolius	FooDB	FooDB
Triadica sebifera	LOTUS Database	35616633
Trianthema portulacastrum	LOTUS Database	35616633
Tribulus terrestris	LOTUS Database	35616633
Trichilia claussenii	LOTUS Database	35616633
Trichilia schomburgkii	LOTUS Database	35616633
Trichocolea tomentella	LOTUS Database	35616633
Trichosanthes kirilowii	KNApSAcK Database	22123792
Trifolium repens	LOTUS Database	35616633
Trigonella calliceras	LOTUS Database	35616633
Trigonella foenum-graecum	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Trigonostemon reidioides	KNApSAcK Database	22123792
Trilophozia quinquedentata	LOTUS Database	35616633
Tripterygium wilfordii	LOTUS Database	35616633
Triticum	FooDB	FooDB
Triticum aestivum	FooDB	PHYTOHUB
Triticum durum	FooDB	FooDB
Triticum spelta	FooDB	FooDB
Triticum turanicum	FooDB	FooDB
Tritomaria quinquedentata (Huds.)	KNApSAcK Database	22123792
Triumfetta cordifolia	LOTUS Database	35616633
Tupistra chinensis	KNApSAcK Database	22123792
Turnera subulata	Plant	KNApSAcK
Turraeanthus africanus	LOTUS Database	35616633
Tussilago farfara	LOTUS Database	35616633
Typha angustifolia	FooDB	FooDB
Typha latifolia	LOTUS Database	35616633
Ula sylvatica	LOTUS Database	35616633
Ulmus pervifolia	KNApSAcK Database	22123792
Ulmus procera	LOTUS Database	35616633
Ulmus pumila	KNApSAcK Database	22123792
Ulmus uyematsui	LOTUS Database	35616633
Unonopsis guatterioides	LOTUS Database	35616633
Urolepis hecatantha	LOTUS Database	35616633
Ursinia nana	LOTUS Database	35616633
Uvaria mocoli	LOTUS Database	35616633
Uvaria scheffleri	LOTUS Database	35616633
Vaccinium	FooDB	FooDB
Vaccinium angustifolium	FooDB	FooDB
Vaccinium angustifolium X Vaccinium corymbosum	FooDB	FooDB
Vaccinium arboreum	FooDB	FooDB
Vaccinium corymbosum	FooDB	FooDB
Vaccinium deliciosum	FooDB	FooDB
Vaccinium elliottii	FooDB	FooDB
Vaccinium macrocarpon	FooDB	FooDB
Vaccinium myrtilloides	FooDB	FooDB
Vaccinium myrtillus	FooDB	FooDB
Vaccinium ovalifolium	FooDB	FooDB
Vaccinium ovatum	FooDB	FooDB
Vaccinium oxycoccos	FooDB	FooDB
Vaccinium parvifolium	FooDB	FooDB
Vaccinium reticulatum	FooDB	FooDB
Vaccinium stamineum	FooDB	FooDB
Vaccinium uliginosum	FooDB	FooDB
Vaccinium vitis-idaea	FooDB	FooDB
Valerianella locusta	FooDB	FooDB
Vanilla	FooDB	FooDB
Vanilla planifolia Jacks.	LOTUS Database	35616633
Vellozia declinans	LOTUS Database	35616633
Ventilago leiocarpa	KNApSAcK Database	22123792
Verbena officinalis	FooDB	FooDB
Vernicia fordii	Plant	KNApSAcK
Vernonanthura chamaedrys	LOTUS Database	35616633
Vernonanthura divaricata	LOTUS Database	35616633
Vernonanthura fagifolia	LOTUS Database	35616633
Vernonanthura nudiflora	LOTUS Database	35616633
Vernonanthura squamulosa	LOTUS Database	35616633
Vernonia cumingiana	LOTUS Database	35616633
Vernonia incana	LOTUS Database	35616633
Vernonia natalensis	LOTUS Database	35616633
Verongula gigantea	LOTUS Database	35616633
Veronica officinalis	Plant	KNApSAcK
Veronica orchidea	Plant	KNApSAcK
Veronica teucrium	Plant	KNApSAcK
Viburnum edule	FooDB	FooDB
Viburnum opulus	LOTUS Database	35616633
Vicia faba	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Vigna aconitifolia	FooDB	FooDB
Vigna angularis	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Vigna mungo	FooDB	FooDB
Vigna radiata	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Vigna umbellata	FooDB	FooDB
Vigna unguiculata	FooDB	FooDB
Vigna unguiculata ssp. cylindrica	FooDB	FooDB
Vigna unguiculata ssp. unguiculata	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Vigna unguiculata var. sesquipedalis	FooDB	FooDB
Viguiera hypargyrea	LOTUS Database	35616633
Viguiera oaxacana	LOTUS Database	35616633
Virola surinamensis	KNApSAcK Database	22123792
Viscum album	LOTUS Database	35616633
Viscum coloratum	KNApSAcK Database	22123792
Vismia laurentii	KNApSAcK Database	22123792
Vitellaria paradoxa	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Vitex quinata	LOTUS Database	35616633
Vitis	FooDB	PHYTOHUB
Vitis aestivalis	FooDB	FooDB
Vitis labrusca	FooDB	FooDB
Vitis rotundifolia	FooDB	FooDB
Vitis vinifera L.	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Volkameria inermis	LOTUS Database	35616633
Wedelia acapulcensis	LOTUS Database	35616633
Wettsteinia inversa	LOTUS Database	35616633
Withania somnifera	KNApSAcK Database	22123792
Xanthium sibiricum	KNApSAcK Database	22123792
Xanthium strumarium	KNApSAcK Database	22123792
Xanthosoma sagittifolium	FooDB	FooDB
Xerxes ekmanianum	LOTUS Database	35616633
Xestospongia testudinaria	LOTUS Database	35616633
Xylocarpus moluccensis	LOTUS Database	35616633
Xylopia aromatica	KNApSAcK Database	22123792
Xylopia brasiliensis	KNApSAcK Database	22123792
Xylopia emarginata	KNApSAcK Database	22123792
Yucca glauca Nutt.	LOTUS Database	35616633
Yucca gloriosa	LOTUS Database	35616633
Zantedeschia aethiopica	LOTUS Database	35616633
Zanthoxylum ailanthoides	LOTUS Database	35616633
Zanthoxylum integrifoliolum	KNApSAcK Database	22123792
Zanthoxylum zanthoxyloides	LOTUS Database	35616633
Zataria multiflora	LOTUS Database	35616633
Zea mays	LOTUS Database	35616633
Zea mays L.	KNApSAcK Database	22123792
Zingiber officinale	FooDB	Dr. Duke's Phytochemical and Ethnobotanical Databases
Zinnia citrea	LOTUS Database	35616633
Zizania	FooDB	FooDB
Zizania aquatica	FooDB	FooDB
Ziziphus jujuba	KNApSAcK Database	22123792
Ziziphus zizyphus	FooDB	FooDB

Species Where Detected

Species Name	Source	Reference
Antrodia camphorata	KNApSAcK Database	22123792
Aureoumbra lagunensis	KNApSAcK Database	22123792
Monascus pilosus BCRC38072	KNApSAcK Database	22123792
Physarum polycephalum	KNApSAcK Database	22123792

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as stigmastanes and derivatives. These are sterol lipids with a structure based on the stigmastane skeleton, which consists of a cholestane moiety bearing an ethyl group at the carbon atom C24.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Sub Class

Stigmastanes and derivatives

Direct Parent

Stigmastanes and derivatives

Alternative Parents

Substituents

C24-propyl-sterol-skeleton
Stigmastane-skeleton
Triterpenoid
3-hydroxy-delta-5-steroid
3-hydroxysteroid
Hydroxysteroid
3-beta-hydroxysteroid
3-beta-hydroxy-delta-5-steroid
Delta-5-steroid
Cyclic alcohol
Secondary alcohol
Alcohol
Organooxygen compound
Hydrocarbon derivative
Organic oxygen compound
Aliphatic homopolycyclic compound

Molecular Framework

Aliphatic homopolycyclic compounds

External Descriptors

3beta-sterol (CHEBI:28824 )
phytosterols (CHEBI:28824 )
stigmastane (C05442 )
Stigmasterols and C24-ethyl derivatives (C05442 )
Stigmastane and derivatives (C05442 )
Stigmasterols and C24-ethyl derivatives (LMST01040123 )

Physical Properties

State

Solid

Experimental Properties

Property	Value	Reference
Melting Point	170 °C	Not Available
Boiling Point	501.00 to 502.00 °C. @ 760.00 mm Hg (est)	The Good Scents Company Information System
Water Solubility	7.3e-05 mg/L @ 25 °C (est)	The Good Scents Company Information System
LogP	10.072 (est)	The Good Scents Company Information System

Predicted Properties

Property	Value	Source
Water Solubility	2.7e-05 g/L	ALOGPS
logP	6.95	ALOGPS
logP	7.48	ChemAxon
logS	-7.2	ALOGPS
pKa (Strongest Acidic)	18.2	ChemAxon
pKa (Strongest Basic)	-1.4	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	1	ChemAxon
Hydrogen Donor Count	1	ChemAxon
Polar Surface Area	20.23 Å²	ChemAxon
Rotatable Bond Count	5	ChemAxon
Refractivity	130.88 m³·mol⁻¹	ChemAxon
Polarizability	53.55 Å³	ChemAxon
Number of Rings	4	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	Yes	ChemAxon
MDDR-like Rule	No	ChemAxon

External Links

HMDB ID

HMDB0000937

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

KNApSAcK ID

Chemspider ID

KEGG Compound ID

BioCyc ID

BiGG ID

Not Available

Wikipedia Link

Stigmasterol

METLIN ID

168

PubChem Compound

5280794

PDB ID

Not Available

ChEBI ID

28824

Good Scents ID

rw1284451

References

General References

Ohdoi C, Nyhan WL, Kuhara T: Chemical diagnosis of Lesch-Nyhan syndrome using gas chromatography-mass spectrometry detection. J Chromatogr B Analyt Technol Biomed Life Sci. 2003 Jul 15;792(1):123-30. [PubMed:12829005 ]
Phillips KM, Ruggio DM, Bailey JA: Precise quantitative determination of phytosterols, stanols, and cholesterol metabolites in human serum by capillary gas-liquid chromatography. J Chromatogr B Biomed Sci Appl. 1999 Sep 10;732(1):17-29. [PubMed:10517218 ]
Kabouche A, Boutaghane N, Kabouche Z, Seguin E, Tillequin F, Benlabed K: Components and antibacterial activity of the roots of Salvia jaminiana. Fitoterapia. 2005 Jul;76(5):450-2. [PubMed:15893885 ]
Noblet JA, Young DL, Zeng EY, Ensari S: Use of fecal steroids to infer the sources of fecal indicator bacteria in the Lower Santa Ana River Watershed, California: sewage is unlikely a significant source. Environ Sci Technol. 2004 Nov 15;38(22):6002-8. [PubMed:15573599 ]
Triana J, Lopez M, Perez FJ, Gonzalez-Platas J, Quintana J, Estevez F, Leon F, Bermejo J: Sesquiterpenoids from Pulicaria canariensis and their cytotoxic activities. J Nat Prod. 2005 Apr;68(4):523-31. [PubMed:15844941 ]
Valsta LM, Lemstrom A, Ovaskainen ML, Lampi AM, Toivo J, Korhonen T, Piironen V: Estimation of plant sterol and cholesterol intake in Finland: quality of new values and their effect on intake. Br J Nutr. 2004 Oct;92(4):671-8. [PubMed:15522137 ]
Miettinen TA: Phytosterolaemia, xanthomatosis and premature atherosclerotic arterial disease: a case with high plant sterol absorption, impaired sterol elimination and low cholesterol synthesis. Eur J Clin Invest. 1980 Feb;10(1):27-35. [PubMed:6768564 ]
Urech K, Scher JM, Hostanska K, Becker H: Apoptosis inducing activity of viscin, a lipophilic extract from Viscum album L. J Pharm Pharmacol. 2005 Jan;57(1):101-9. [PubMed:15638998 ]
Morin RJ, Elms NJ: Rapid microanalysis of cholesterol in bile and serum by gas chromatography. Ann Clin Lab Sci. 1975 Jan-Feb;5(1):52-6. [PubMed:1111441 ]

Showing NP-Card for Stigmasterol (NP0001428)

MOL for NP0001428 (Stigmasterol)

3D MOL for NP0001428 (Stigmasterol)

3D SDF for NP0001428 (Stigmasterol)

3D-SDF for NP0001428 (Stigmasterol)

PDB for NP0001428 (Stigmasterol)

3D PDB for NP0001428 (Stigmasterol)

SMILES for NP0001428 (Stigmasterol)

INCHI for NP0001428 (Stigmasterol)

Structure for NP0001428 (Stigmasterol)

3D Structure for NP0001428 (Stigmasterol)