NP-MRD: Showing NP-Card for Orthosphenic acid (NP0075633)

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Record Information

Version

2.0

Created at

2022-04-28 20:53:32 UTC

Updated at

2022-04-28 20:53:32 UTC

NP-MRD ID

NP0075633

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Orthosphenic acid

Description

(1S,4S,5R,8S,11R,13R,14S,17R,18S,20R,21R,24R)-20,21-dihydroxy-5,8,11,14,17,24-hexamethyl-22-oxahexacyclo[19.2.1.0¹,¹⁸.0⁴,¹⁷.0⁵,¹⁴.0⁸,¹³]Tetracosane-11-carboxylic acid belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units. Orthosphenic acid is found in Orthosphenia mexicana Standley., Salacia prinoides, Tripterygium regelii, Tripterygium wilfordii and Tripterygium wilfordii Hook f. . Based on a literature review very few articles have been published on (1S,4S,5R,8S,11R,13R,14S,17R,18S,20R,21R,24R)-20,21-dihydroxy-5,8,11,14,17,24-hexamethyl-22-oxahexacyclo[19.2.1.0¹,¹⁸.0⁴,¹⁷.0⁵,¹⁴.0⁸,¹³]Tetracosane-11-carboxylic acid.

Structure

MOL SDF PDB SMILES InChI


  Mrv1652304282222532D          

 35 40  0  0  1  0            999 V2000
    0.1519   -0.4058    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.3937    0.2657    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.1885    0.7183    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.6963    1.2414    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.2554    0.5528    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.9979   -0.2776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0851    0.6395    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.4202    1.3933    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.9396    2.0715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1099    1.9911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2406    1.4801    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.7260    0.8130    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.3909    0.0591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5705   -0.0277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5464    0.8997    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.8815    1.6536    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.3961    2.3208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5757    2.2340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7019    1.7404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1872    1.0733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8522    0.3194    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.0318    0.2326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5939   -0.0418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9675   -0.4975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3177   -1.0059    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   -0.8061    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2165    2.4075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2113    0.1459    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7553    2.1472    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7495   -0.1142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1041    1.6502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7412    1.0569    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7390    0.1038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0979   -0.1642    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1457   -1.1753    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  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  1  6  0  0  0
  1  6  1  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  6  0  0  0
  9 10  1  0  0  0  0
  4 10  1  0  0  0  0
  8 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
  7 14  1  0  0  0  0
 12 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 11 18  1  0  0  0  0
 16 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 15 22  1  1  0  0  0
 21 23  1  6  0  0  0
 21 24  1  1  0  0  0
 24 25  2  0  0  0  0
 24 26  1  0  0  0  0
 16 27  1  6  0  0  0
 12 28  1  1  0  0  0
 11 29  1  6  0  0  0
  7 30  1  6  0  0  0
  4 31  1  1  0  0  0
 31 32  1  0  0  0  0
  2 32  1  0  0  0  0
  3 33  1  1  0  0  0
  2 34  1  1  0  0  0
  1 35  1  1  0  0  0
M  END


  Mrv1652304282222532D          

 35 40  0  0  1  0            999 V2000
    0.1519   -0.4058    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.3937    0.2657    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.1885    0.7183    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.6963    1.2414    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.2554    0.5528    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.9979   -0.2776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0851    0.6395    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.4202    1.3933    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.9396    2.0715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1099    1.9911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2406    1.4801    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.7260    0.8130    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.3909    0.0591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5705   -0.0277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5464    0.8997    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.8815    1.6536    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.3961    2.3208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5757    2.2340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7019    1.7404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1872    1.0733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8522    0.3194    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.0318    0.2326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5939   -0.0418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9675   -0.4975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3177   -1.0059    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   -0.8061    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2165    2.4075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2113    0.1459    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7553    2.1472    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7495   -0.1142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1041    1.6502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7412    1.0569    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7390    0.1038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0979   -0.1642    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1457   -1.1753    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  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  1  6  0  0  0
  1  6  1  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  6  0  0  0
  9 10  1  0  0  0  0
  4 10  1  0  0  0  0
  8 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
  7 14  1  0  0  0  0
 12 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 11 18  1  0  0  0  0
 16 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 15 22  1  1  0  0  0
 21 23  1  6  0  0  0
 21 24  1  1  0  0  0
 24 25  2  0  0  0  0
 24 26  1  0  0  0  0
 16 27  1  6  0  0  0
 12 28  1  1  0  0  0
 11 29  1  6  0  0  0
  7 30  1  6  0  0  0
  4 31  1  1  0  0  0
 31 32  1  0  0  0  0
  2 32  1  0  0  0  0
  3 33  1  1  0  0  0
  2 34  1  1  0  0  0
  1 35  1  1  0  0  0
M  END
> <DATABASE_ID>
NP0075633

> <DATABASE_NAME>
NP-MRD

> <SMILES>
C[C@H]1[C@@]2(O)OC[C@]11CC[C@H]3[C@@](C)(CC[C@@]4(C)[C@@H]5C[C@@](C)(CC[C@]5(C)CC[C@]34C)C(O)=O)[C@@H]1C[C@H]2O

> <INCHI_IDENTIFIER>
InChI=1S/C30H48O5/c1-18-29-8-7-19-26(4,20(29)15-22(31)30(18,34)35-17-29)12-14-28(6)21-16-25(3,23(32)33)10-9-24(21,2)11-13-27(19,28)5/h18-22,31,34H,7-17H2,1-6H3,(H,32,33)/t18-,19+,20+,21-,22-,24-,25-,26-,27-,28+,29-,30-/m1/s1

> <INCHI_KEY>
JPAXVSRGFJVPEU-PFCJNZICSA-N

> <FORMULA>
C30H48O5

> <MOLECULAR_WEIGHT>
488.709

> <EXACT_MASS>
488.350174646

> <JCHEM_ACCEPTOR_COUNT>
5

> <JCHEM_ATOM_COUNT>
83

> <JCHEM_AVERAGE_POLARIZABILITY>
34.88794393683789

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
3

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(1S,4S,5R,8S,11R,13R,14S,17R,18S,20R,21R,24R)-20,21-dihydroxy-5,8,11,14,17,24-hexamethyl-22-oxahexacyclo[19.2.1.0^{1,18}.0^{4,17}.0^{5,14}.0^{8,13}]tetracosane-11-carboxylic acid

> <ALOGPS_LOGP>
4.86

> <JCHEM_LOGP>
5.424453218666665

> <ALOGPS_LOGS>
-5.58

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
6

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
10.943782359573461

> <JCHEM_PKA_STRONGEST_ACIDIC>
4.773279929006583

> <JCHEM_PKA_STRONGEST_BASIC>
-3.5696119280174043

> <JCHEM_POLAR_SURFACE_AREA>
86.99000000000001

> <JCHEM_REFRACTIVITY>
134.00010000000003

> <JCHEM_ROTATABLE_BOND_COUNT>
1

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.27e-03 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(1S,4S,5R,8S,11R,13R,14S,17R,18S,20R,21R,24R)-20,21-dihydroxy-5,8,11,14,17,24-hexamethyl-22-oxahexacyclo[19.2.1.0^{1,18}.0^{4,17}.0^{5,14}.0^{8,13}]tetracosane-11-carboxylic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 28-APR-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   28-APR-22         0                                  
HETATM    1  C   UNK     0       0.284  -0.758   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -0.735   0.496   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       0.352   1.341   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       1.300   2.317   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       2.343   1.032   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       1.863  -0.518   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       3.892   1.194   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       4.518   2.601   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       3.621   3.867   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       2.072   3.717   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       6.049   2.763   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       6.955   1.518   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       6.330   0.110   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       4.798  -0.052   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       8.487   1.680   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       9.112   3.087   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       8.206   4.332   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       6.675   4.170   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      10.644   3.249   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      11.550   2.003   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      10.924   0.596   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       9.393   0.434   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      12.309  -0.078   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      11.139  -0.929   0.000  0.00  0.00           C+0
HETATM   25  O   UNK     0       9.926  -1.878   0.000  0.00  0.00           O+0
HETATM   26  O   UNK     0      12.568  -1.505   0.000  0.00  0.00           O+0
HETATM   27  C   UNK     0       9.738   4.494   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0       7.861   0.272   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0       5.143   4.008   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0       3.266  -0.213   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0      -0.194   3.080   0.000  0.00  0.00           C+0
HETATM   32  O   UNK     0      -1.383   1.973   0.000  0.00  0.00           O+0
HETATM   33  C   UNK     0       1.379   0.194   0.000  0.00  0.00           C+0
HETATM   34  O   UNK     0      -2.049  -0.306   0.000  0.00  0.00           O+0
HETATM   35  O   UNK     0      -0.272  -2.194   0.000  0.00  0.00           O+0
CONECT    1    2    6   35                                                  
CONECT    2    1    3   32   34                                             
CONECT    3    2    4   33                                                  
CONECT    4    3    5   10   31                                             
CONECT    5    4    6    7                                                  
CONECT    6    5    1                                                       
CONECT    7    5    8   14   30                                             
CONECT    8    7    9   11                                                  
CONECT    9    8   10                                                       
CONECT   10    9    4                                                       
CONECT   11    8   12   18   29                                             
CONECT   12   11   13   15   28                                             
CONECT   13   12   14                                                       
CONECT   14   13    7                                                       
CONECT   15   12   16   22                                                  
CONECT   16   15   17   19   27                                             
CONECT   17   16   18                                                       
CONECT   18   17   11                                                       
CONECT   19   16   20                                                       
CONECT   20   19   21                                                       
CONECT   21   20   22   23   24                                             
CONECT   22   21   15                                                       
CONECT   23   21                                                            
CONECT   24   21   25   26                                                  
CONECT   25   24                                                            
CONECT   26   24                                                            
CONECT   27   16                                                            
CONECT   28   12                                                            
CONECT   29   11                                                            
CONECT   30    7                                                            
CONECT   31    4   32                                                       
CONECT   32   31    2                                                       
CONECT   33    3                                                            
CONECT   34    2                                                            
CONECT   35    1                                                            
MASTER        0    0    0    0    0    0    0    0   35    0   80    0
END

View in JSmol

Synonyms

Value	Source
(1S,4S,5R,8S,11R,13R,14S,17R,18S,20R,21R,24R)-20,21-Dihydroxy-5,8,11,14,17,24-hexamethyl-22-oxahexacyclo[19.2.1.0,.0,.0,.0,]tetracosane-11-carboxylate	Generator

Chemical Formula

C₃₀H₄₈O₅

Average Mass

488.7090 Da

Monoisotopic Mass

488.35017 Da

IUPAC Name

(1S,4S,5R,8S,11R,13R,14S,17R,18S,20R,21R,24R)-20,21-dihydroxy-5,8,11,14,17,24-hexamethyl-22-oxahexacyclo[19.2.1.0^{1,18}.0^{4,17}.0^{5,14}.0^{8,13}]tetracosane-11-carboxylic acid

Traditional Name

(1S,4S,5R,8S,11R,13R,14S,17R,18S,20R,21R,24R)-20,21-dihydroxy-5,8,11,14,17,24-hexamethyl-22-oxahexacyclo[19.2.1.0^{1,18}.0^{4,17}.0^{5,14}.0^{8,13}]tetracosane-11-carboxylic acid

CAS Registry Number

Not Available

SMILES

C[C@H]1[C@@]2(O)OC[C@]11CC[C@H]3[C@@](C)(CC[C@@]4(C)[C@@H]5C[C@@](C)(CC[C@]5(C)CC[C@]34C)C(O)=O)[C@@H]1C[C@H]2O

InChI Identifier

InChI=1S/C30H48O5/c1-18-29-8-7-19-26(4,20(29)15-22(31)30(18,34)35-17-29)12-14-28(6)21-16-25(3,23(32)33)10-9-24(21,2)11-13-27(19,28)5/h18-22,31,34H,7-17H2,1-6H3,(H,32,33)/t18-,19+,20+,21-,22-,24-,25-,26-,27-,28+,29-,30-/m1/s1

InChI Key

JPAXVSRGFJVPEU-PFCJNZICSA-N

Experimental Spectra

Not Available

Predicted Spectra

Not Available

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Orthosphenia mexicana Standley.	Plant	KNApSAcK
Salacia prinoides	Plant	KNApSAcK
Tripterygium regelii	Plant	KNApSAcK
Tripterygium wilfordii	LOTUS Database	35616633
Tripterygium wilfordii Hook f.	Plant	KNApSAcK

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Prenol lipids

Sub Class

Triterpenoids

Direct Parent

Triterpenoids

Alternative Parents

Substituents

Triterpenoid
Oxepane
Tetrahydrofuran
Cyclic alcohol
Secondary alcohol
Hemiacetal
Oxacycle
Organoheterocyclic compound
Monocarboxylic acid or derivatives
Carboxylic acid
Carboxylic acid derivative
Organic oxygen compound
Organic oxide
Hydrocarbon derivative
Organooxygen compound
Carbonyl group
Alcohol
Aliphatic heteropolycyclic compound

Molecular Framework

Aliphatic 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
logP	4.86	ALOGPS
logP	5.42	ChemAxon
logS	-5.6	ALOGPS
pKa (Strongest Acidic)	4.77	ChemAxon
pKa (Strongest Basic)	-3.6	ChemAxon
Physiological Charge	-1	ChemAxon
Hydrogen Acceptor Count	5	ChemAxon
Hydrogen Donor Count	3	ChemAxon
Polar Surface Area	86.99 Å²	ChemAxon
Rotatable Bond Count	1	ChemAxon
Refractivity	134 m³·mol⁻¹	ChemAxon
Polarizability	34.89 Å³	ChemAxon
Number of Rings	6	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

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

Not Available

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

154497141

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Not Available

Showing NP-Card for Orthosphenic acid (NP0075633)

MOL for NP0075633 (Orthosphenic acid)

3D MOL for NP0075633 (Orthosphenic acid)

3D SDF for NP0075633 (Orthosphenic acid)

3D-SDF for NP0075633 (Orthosphenic acid)

PDB for NP0075633 (Orthosphenic acid)

3D PDB for NP0075633 (Orthosphenic acid)

SMILES for NP0075633 (Orthosphenic acid)

INCHI for NP0075633 (Orthosphenic acid)

Structure for NP0075633 (Orthosphenic acid)

3D Structure for NP0075633 (Orthosphenic acid)