NP-MRD: Showing NP-Card for Teucrin A (NP0140984)

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Record Information

Version

2.0

Created at

2022-06-29 22:01:43 UTC

Updated at

2022-06-29 22:01:43 UTC

NP-MRD ID

NP0140984

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Teucrin A

Description

Teucrin A belongs to the class of organic compounds known as gamma butyrolactones. Gamma butyrolactones are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a ketone group on the carbon adjacent to the oxygen atom. Teucrin A is found in Teucrium chamaedrys, Teucrium divaricatum, Teucrium microphyllum, Teucrium polium and Teucrium webbianum. Based on a literature review very few articles have been published on Teucrin A.

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652306302200012D          

 25 29  0  0  1  0            999 V2000
    2.9374    1.9668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3678    1.3700    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.5662    1.5649    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.9966    0.9680    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.2286    0.1764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5474   -0.2890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6098   -1.1116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3534   -1.4689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0346   -1.0036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0303   -0.0185    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.5999    0.5783    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.2287    1.1123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9309    0.6792    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.7360   -0.1224    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9134   -0.1848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4803   -0.8870    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6940    0.9927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8889    1.7944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7115    1.8568    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0251    1.0937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3962    0.5597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1057    0.2151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8974   -0.0169    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1719    0.9920    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3341    2.3565    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  1  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  1  0  0  0
 10 11  1  0  0  0  0
  2 11  1  0  0  0  0
 11 12  1  6  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 11 15  1  0  0  0  0
 15 16  2  0  0  0  0
 13 17  1  1  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 17 21  1  0  0  0  0
  6 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
  4 24  1  1  0  0  0
  3 25  1  1  0  0  0
M  END

     RDKit          3D

 45 49  0  0  0  0  0  0  0  0999 V2000
    0.2297   -2.0695    1.3683 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0389   -1.5427   -0.0270 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.0234   -2.0201   -0.9466 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.3345   -3.3486   -0.5692 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3072   -1.2493   -0.8725 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.3673   -1.9275   -0.2560 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0804   -0.9993    0.5275 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2045   -1.1474    1.0731 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2623    0.2309    0.6106 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1820   -0.0150   -0.0801 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9420    0.7722   -0.1293 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.0395    1.8143    0.9654 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4009    2.4930    0.7577 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4426    1.5395    1.2692 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3001   -0.0692   -0.0437 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.2607    0.3090   -1.1528 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2693    1.2362   -0.5878 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.6686    0.7840   -0.7379 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2214   -0.1778   -1.5368 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5741   -0.1982   -1.2885 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8190    0.7099   -0.3826 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7208    1.3277   -0.0165 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9039    1.3863    0.7589 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0474    0.3636    1.1659 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9835   -0.0508    2.3482 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7406   -3.0658    1.2392 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7330   -2.3288    1.8899 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8759   -1.4139    1.9643 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9980   -2.0423   -0.3504 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6830   -2.0904   -1.9922 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9617   -3.7568   -1.2101 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6258   -0.9742   -1.8972 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9751    1.3587   -1.0948 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2705    2.5918    0.8910 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1026    1.3461    1.9779 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4272    3.4813    1.2282 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5715    2.6284   -0.3426 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4624    1.9523    1.0520 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3170    1.4508    2.3874 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7351    0.6897   -2.0514 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7687   -0.6412   -1.4601 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1900    2.2094   -1.1526 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6576   -0.7856   -2.2222 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2512   -0.8736   -1.7924 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6881    2.1127    0.7183 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
  3  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 11 15  1  0
 15 16  1  0
 16 17  1  0
 17 23  1  0
 23 24  1  0
 24 25  2  0
 17 18  1  0
 18 22  2  0
 22 21  1  0
 21 20  1  0
 20 19  2  0
 15  2  1  0
 15 24  1  1
 19 18  1  0
 10  5  1  0
 14  9  1  0
  1 26  1  0
  1 27  1  0
  1 28  1  0
  2 29  1  6
  3 30  1  6
  4 31  1  0
  5 32  1  6
 11 33  1  6
 12 34  1  0
 12 35  1  0
 13 36  1  0
 13 37  1  0
 14 38  1  0
 14 39  1  0
 16 40  1  0
 16 41  1  0
 17 42  1  6
 22 45  1  0
 20 44  1  0
 19 43  1  0
M  END


  Mrv1652306302200012D          

 25 29  0  0  1  0            999 V2000
    2.9374    1.9668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3678    1.3700    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.5662    1.5649    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.9966    0.9680    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.2286    0.1764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5474   -0.2890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6098   -1.1116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3534   -1.4689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0346   -1.0036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0303   -0.0185    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.5999    0.5783    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.2287    1.1123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9309    0.6792    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.7360   -0.1224    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9134   -0.1848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4803   -0.8870    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6940    0.9927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8889    1.7944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7115    1.8568    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0251    1.0937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3962    0.5597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1057    0.2151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8974   -0.0169    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1719    0.9920    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3341    2.3565    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  1  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  1  0  0  0
 10 11  1  0  0  0  0
  2 11  1  0  0  0  0
 11 12  1  6  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 11 15  1  0  0  0  0
 15 16  2  0  0  0  0
 13 17  1  1  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 17 21  1  0  0  0  0
  6 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
  4 24  1  1  0  0  0
  3 25  1  1  0  0  0
M  END
> <DATABASE_ID>
NP0140984

> <DATABASE_NAME>
NP-MRD

> <SMILES>
C[C@@H]1[C@H](O)[C@@H]2OC(=O)C3=C2[C@H](CCC3)[C@@]11C[C@H](OC1=O)C1=COC=C1

> <INCHI_IDENTIFIER>
InChI=1S/C19H20O6/c1-9-15(20)16-14-11(17(21)25-16)3-2-4-12(14)19(9)7-13(24-18(19)22)10-5-6-23-8-10/h5-6,8-9,12-13,15-16,20H,2-4,7H2,1H3/t9-,12+,13+,15+,16-,19-/m1/s1

> <INCHI_KEY>
AONLJCCUYGGOSW-PJERILTQSA-N

> <FORMULA>
C19H20O6

> <MOLECULAR_WEIGHT>
344.363

> <EXACT_MASS>
344.125988364

$$$$

HEADER    PROTEIN                                 30-JUN-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   30-JUN-22         0                                  
HETATM    1  C   UNK     0       5.483   3.671   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       4.420   2.557   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       2.924   2.921   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       1.860   1.807   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       2.293   0.329   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       1.022  -0.539   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       1.138  -2.075   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       2.526  -2.742   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       3.798  -1.873   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       3.790  -0.035   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       4.853   1.079   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       6.027   2.076   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       7.338   1.268   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0       6.974  -0.229   0.000  0.00  0.00           O+0
HETATM   15  C   UNK     0       5.438  -0.345   0.000  0.00  0.00           C+0
HETATM   16  O   UNK     0       4.630  -1.656   0.000  0.00  0.00           O+0
HETATM   17  C   UNK     0       8.762   1.853   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       9.126   3.350   0.000  0.00  0.00           C+0
HETATM   19  O   UNK     0      10.662   3.466   0.000  0.00  0.00           O+0
HETATM   20  C   UNK     0      11.247   2.042   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      10.073   1.045   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      -0.197   0.402   0.000  0.00  0.00           C+0
HETATM   23  O   UNK     0      -1.675  -0.032   0.000  0.00  0.00           O+0
HETATM   24  O   UNK     0       0.321   1.852   0.000  0.00  0.00           O+0
HETATM   25  O   UNK     0       2.490   4.399   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3   11                                                  
CONECT    3    2    4   25                                                  
CONECT    4    3    5   24                                                  
CONECT    5    4    6   10                                                  
CONECT    6    5    7   22                                                  
CONECT    7    6    8                                                       
CONECT    8    7    9                                                       
CONECT    9    8   10                                                       
CONECT   10    9    5   11                                                  
CONECT   11   10    2   12   15                                             
CONECT   12   11   13                                                       
CONECT   13   12   14   17                                                  
CONECT   14   13   15                                                       
CONECT   15   14   11   16                                                  
CONECT   16   15                                                            
CONECT   17   13   18   21                                                  
CONECT   18   17   19                                                       
CONECT   19   18   20                                                       
CONECT   20   19   21                                                       
CONECT   21   20   17                                                       
CONECT   22    6   23   24                                                  
CONECT   23   22                                                            
CONECT   24   22    4                                                       
CONECT   25    3                                                            
MASTER        0    0    0    0    0    0    0    0   25    0   58    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₁₉H₂₀O₆

Average Mass

344.3630 Da

Monoisotopic Mass

344.12599 Da

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

C[C@@H]1[C@H](O)[C@@H]2OC(=O)C3=C2[C@H](CCC3)[C@@]11C[C@H](OC1=O)C1=COC=C1

InChI Identifier

InChI=1S/C19H20O6/c1-9-15(20)16-14-11(17(21)25-16)3-2-4-12(14)19(9)7-13(24-18(19)22)10-5-6-23-8-10/h5-6,8-9,12-13,15-16,20H,2-4,7H2,1H3/t9-,12+,13+,15+,16-,19-/m1/s1

InChI Key

AONLJCCUYGGOSW-PJERILTQSA-N

Experimental Spectra

Not Available

Predicted Spectra

Spectrum Type	Description	Depositor ID	Depositor Organization	Depositor	Deposition Date	View
1D NMR	¹³C NMR Spectrum (1D, 25 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 100 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 252 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 1000 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 50 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 200 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 75 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 300 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 101 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 400 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 126 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 500 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 151 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 176 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 700 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 201 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 800 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 226 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 900 MHz, H₂O, 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
Teucrium chamaedrys	LOTUS Database	35616633
Teucrium divaricatum	LOTUS Database	35616633
Teucrium microphyllum	LOTUS Database	35616633
Teucrium polium	LOTUS Database	35616633
Teucrium webbianum	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as gamma butyrolactones. Gamma butyrolactones are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a ketone group on the carbon adjacent to the oxygen atom.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Lactones

Sub Class

Gamma butyrolactones

Direct Parent

Gamma butyrolactones

Alternative Parents

Substituents

2-furanone
Dicarboxylic acid or derivatives
Gamma butyrolactone
Cyclic alcohol
Dihydrofuran
Furan
Tetrahydrofuran
Enoate ester
Alpha,beta-unsaturated carboxylic ester
Heteroaromatic compound
Secondary alcohol
Carboxylic acid ester
Carboxylic acid derivative
Oxacycle
Hydrocarbon derivative
Organic oxygen compound
Organic oxide
Organooxygen compound
Carbonyl group
Alcohol
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

Not Available

Physical Properties

State

Not Available

Experimental Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	Not Available	Not Available

Predicted Properties

Property	Value	Source

External Links

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

Not Available

KNApSAcK ID

Not Available

Chemspider ID

140277

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

159529

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Not Available

Showing NP-Card for Teucrin A (NP0140984)

MOL for NP0140984 (Teucrin A)

3D MOL for NP0140984 (Teucrin A)

3D SDF for NP0140984 (Teucrin A)

3D-SDF for NP0140984 (Teucrin A)

PDB for NP0140984 (Teucrin A)

3D PDB for NP0140984 (Teucrin A)

SMILES for NP0140984 (Teucrin A)

INCHI for NP0140984 (Teucrin A)

Structure for NP0140984 (Teucrin A)

3D Structure for NP0140984 (Teucrin A)