NP-MRD: Showing NP-Card for Isogambogic acid (NP0139926)

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Record Information

Version

2.0

Created at

2022-06-29 20:16:59 UTC

Updated at

2022-06-29 20:16:59 UTC

NP-MRD ID

NP0139926

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Isogambogic acid

Description

Isogambogic acid, also known as isogambogate, belongs to the class of organic compounds known as pyranoxanthones. These are organic aromatic compounds containing a pyran or a hydrogenated derivative fused to a xanthone ring system. Isogambogic acid is found in Garcinia hanburyi. Isogambogic acid was first documented in 2007 (PMID: 17396587). Based on a literature review a small amount of articles have been published on Isogambogic acid (PMID: 18254140) (PMID: 18006779).

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652306292222172D          

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M  END

     RDKit          3D

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M  END


  Mrv1652306292222172D          

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    4.0366    0.6084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3341    1.0410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6083    0.6488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5849   -0.1758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2875   -0.6084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0133   -0.2163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7158   -0.6488    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3560   -1.5289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0466   -2.0428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9509   -2.8623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1934   -3.1892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6127   -3.3548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6047   -0.5065    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9861   -0.2082    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.0505   -0.6614    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.5825   -0.1215    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1156    0.3470    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.3765    1.0509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1071    0.6483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8811    1.0659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8342    1.9243    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5126   -0.6678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4995   -0.8678    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2074   -0.9152    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.8497   -1.6497    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0464   -1.4567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0239   -2.3665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9447   -1.8388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1586   -0.8317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6677   -1.5532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3217   -2.3022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5001   -2.3770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7973   -2.9763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3408   -3.5970    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4514   -3.7252    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3971    1.9267    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8157   -1.0748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2208   -1.8084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  6  5  1  1  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
  9 14  1  0  0  0  0
 14 15  1  0  0  0  0
  6 15  1  0  0  0  0
 13 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 12 21  1  0  0  0  0
 22 21  1  1  0  0  0
 22 23  1  0  0  0  0
 23 24  1  6  0  0  0
 25 24  1  1  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 22 27  1  0  0  0  0
 27 28  1  0  0  0  0
 11 28  1  0  0  0  0
 28 29  2  0  0  0  0
 25 30  1  0  0  0  0
 30 31  2  0  0  0  0
 30 32  1  0  0  0  0
 22 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 23 34  1  0  0  0  0
 34 35  1  0  0  0  0
 34 36  1  0  0  0  0
 32 37  1  6  0  0  0
 37 38  1  0  0  0  0
 38 39  2  0  0  0  0
 39 40  1  0  0  0  0
 39 41  1  0  0  0  0
 41 42  2  0  0  0  0
 41 43  1  0  0  0  0
 10 44  1  0  0  0  0
  6 45  1  6  0  0  0
  2 46  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0139926

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC(C)=CCC[C@@]1(C)OC2=C(CC=C(C)C)C3=C(C(O)=C2C=C1)C(=O)C1=C[C@@H]2C[C@H]4C(C)(C)O[C@@](C\C=C(/C)C(O)=O)(C2=O)[C@@]14O3

> <INCHI_IDENTIFIER>
InChI=1S/C38H44O8/c1-20(2)10-9-15-36(8)16-14-24-29(39)28-30(40)26-18-23-19-27-35(6,7)46-37(33(23)41,17-13-22(5)34(42)43)38(26,27)45-32(28)25(31(24)44-36)12-11-21(3)4/h10-11,13-14,16,18,23,27,39H,9,12,15,17,19H2,1-8H3,(H,42,43)/b22-13+/t23-,27+,36-,37+,38-/m1/s1

> <INCHI_KEY>
GEZHEQNLKAOMCA-GXSDCXQCSA-N

> <FORMULA>
C38H44O8

> <MOLECULAR_WEIGHT>
628.762

> <EXACT_MASS>
628.303618377

> <JCHEM_ACCEPTOR_COUNT>
8

> <JCHEM_ATOM_COUNT>
90

> <JCHEM_AVERAGE_POLARIZABILITY>
69.32893884922359

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(2E)-4-[(1S,2S,8R,17S,19R)-12-hydroxy-8,21,21-trimethyl-5-(3-methylbut-2-en-1-yl)-8-(4-methylpent-3-en-1-yl)-14,18-dioxo-3,7,20-trioxahexacyclo[15.4.1.0^{2,15}.0^{2,19}.0^{4,13}.0^{6,11}]docosa-4(13),5,9,11,15-pentaen-19-yl]-2-methylbut-2-enoic acid

> <ALOGPS_LOGP>
5.57

> <JCHEM_LOGP>
7.783757148666668

> <ALOGPS_LOGS>
-5.95

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
6

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
8.581534076913156

> <JCHEM_PKA_STRONGEST_ACIDIC>
3.756820345287422

> <JCHEM_PKA_STRONGEST_BASIC>
-4.135788451877827

> <JCHEM_POLAR_SURFACE_AREA>
119.36000000000001

> <JCHEM_REFRACTIVITY>
179.16160000000008

> <JCHEM_ROTATABLE_BOND_COUNT>
8

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
7.12e-04 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(2E)-4-[(1S,2S,8R,17S,19R)-12-hydroxy-8,21,21-trimethyl-5-(3-methylbut-2-en-1-yl)-8-(4-methylpent-3-en-1-yl)-14,18-dioxo-3,7,20-trioxahexacyclo[15.4.1.0^{2,15}.0^{2,19}.0^{4,13}.0^{6,11}]docosa-4(13),5,9,11,15-pentaen-19-yl]-2-methylbut-2-enoic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 29-JUN-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   29-JUN-22         0                                  
HETATM    1  C   UNK     0      17.092  -1.360   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      15.637  -1.864   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      14.473  -0.855   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      13.017  -1.359   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      11.827  -0.328   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      10.158  -0.479   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      10.201   1.060   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       8.890   1.868   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       7.535   1.136   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       6.224   1.943   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       4.869   1.211   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       4.825  -0.328   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       6.137  -1.136   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       7.492  -0.404   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0       8.803  -1.211   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0       6.265  -2.854   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       7.554  -3.813   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       7.375  -5.343   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       5.961  -5.953   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       8.610  -6.262   0.000  0.00  0.00           C+0
HETATM   21  O   UNK     0       2.995  -0.945   0.000  0.00  0.00           O+0
HETATM   22  C   UNK     0       1.841  -0.389   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      -0.094  -1.235   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      -1.087  -0.227   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      -0.216   0.648   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       0.703   1.962   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0       2.067   1.210   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0       3.511   1.990   0.000  0.00  0.00           C+0
HETATM   29  O   UNK     0       3.424   3.592   0.000  0.00  0.00           O+0
HETATM   30  C   UNK     0       0.957  -1.247   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0      -0.932  -1.620   0.000  0.00  0.00           O+0
HETATM   32  C   UNK     0       2.254  -1.708   0.000  0.00  0.00           C+0
HETATM   33  O   UNK     0       1.586  -3.079   0.000  0.00  0.00           O+0
HETATM   34  C   UNK     0       0.087  -2.719   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0      -0.045  -4.418   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0      -1.763  -3.432   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0       4.029  -1.552   0.000  0.00  0.00           C+0
HETATM   38  C   UNK     0       4.980  -2.899   0.000  0.00  0.00           C+0
HETATM   39  C   UNK     0       4.334  -4.297   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0       2.800  -4.437   0.000  0.00  0.00           C+0
HETATM   41  C   UNK     0       5.222  -5.556   0.000  0.00  0.00           C+0
HETATM   42  O   UNK     0       6.236  -6.714   0.000  0.00  0.00           O+0
HETATM   43  O   UNK     0       4.576  -6.954   0.000  0.00  0.00           O+0
HETATM   44  O   UNK     0       6.341   3.597   0.000  0.00  0.00           O+0
HETATM   45  C   UNK     0      10.856  -2.006   0.000  0.00  0.00           C+0
HETATM   46  C   UNK     0      15.345  -3.376   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3   46                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5    7   15   45                                             
CONECT    7    6    8                                                       
CONECT    8    7    9                                                       
CONECT    9    8   10   14                                                  
CONECT   10    9   11   44                                                  
CONECT   11   10   12   28                                                  
CONECT   12   11   13   21                                                  
CONECT   13   12   14   16                                                  
CONECT   14   13    9   15                                                  
CONECT   15   14    6                                                       
CONECT   16   13   17                                                       
CONECT   17   16   18                                                       
CONECT   18   17   19   20                                                  
CONECT   19   18                                                            
CONECT   20   18                                                            
CONECT   21   12   22                                                       
CONECT   22   21   23   27   32                                             
CONECT   23   22   24   34                                                  
CONECT   24   23   25                                                       
CONECT   25   24   26   30                                                  
CONECT   26   25   27                                                       
CONECT   27   26   22   28                                                  
CONECT   28   27   11   29                                                  
CONECT   29   28                                                            
CONECT   30   25   31   32                                                  
CONECT   31   30                                                            
CONECT   32   30   22   33   37                                             
CONECT   33   32   34                                                       
CONECT   34   33   23   35   36                                             
CONECT   35   34                                                            
CONECT   36   34                                                            
CONECT   37   32   38                                                       
CONECT   38   37   39                                                       
CONECT   39   38   40   41                                                  
CONECT   40   39                                                            
CONECT   41   39   42   43                                                  
CONECT   42   41                                                            
CONECT   43   41                                                            
CONECT   44   10                                                            
CONECT   45    6                                                            
CONECT   46    2                                                            
MASTER        0    0    0    0    0    0    0    0   46    0  102    0
END

View in JSmol

Synonyms

Value	Source
Isogambogate	Generator

Chemical Formula

C₃₈H₄₄O₈

Average Mass

628.7620 Da

Monoisotopic Mass

628.30362 Da

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

CC(C)=CCC[C@@]1(C)OC2=C(CC=C(C)C)C3=C(C(O)=C2C=C1)C(=O)C1=C[C@@H]2C[C@H]4C(C)(C)O[C@@](C\C=C(/C)C(O)=O)(C2=O)[C@@]14O3

InChI Identifier

InChI=1S/C38H44O8/c1-20(2)10-9-15-36(8)16-14-24-29(39)28-30(40)26-18-23-19-27-35(6,7)46-37(33(23)41,17-13-22(5)34(42)43)38(26,27)45-32(28)25(31(24)44-36)12-11-21(3)4/h10-11,13-14,16,18,23,27,39H,9,12,15,17,19H2,1-8H3,(H,42,43)/b22-13+/t23-,27+,36-,37+,38-/m1/s1

InChI Key

GEZHEQNLKAOMCA-GXSDCXQCSA-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
Garcinia hanburyi	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as pyranoxanthones. These are organic aromatic compounds containing a pyran or a hydrogenated derivative fused to a xanthone ring system.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Benzopyrans

Sub Class

1-benzopyrans

Direct Parent

Pyranoxanthones

Alternative Parents

Substituents

Pyranoxanthone
Pyranochromene
Chromone
Aromatic monoterpenoid
Monoterpenoid
Aryl ketone
Alkyl aryl ether
Phenol
Oxepane
Cyclohexenone
Benzenoid
Vinylogous acid
Oxolane
Ketone
Oxacycle
Carboxylic acid derivative
Carboxylic acid
Dialkyl ether
Ether
Monocarboxylic acid or derivatives
Organic oxide
Carbonyl group
Hydrocarbon derivative
Organic oxygen compound
Organooxygen compound
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

C00030529

Chemspider ID

58802073

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

70697925

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Li SL, Song JZ, Han QB, Qiao CF, Xu HX: Improved high-performance liquid chromatographic method for simultaneous determination of 12 cytotoxic caged xanthones in gamboges, a potential anticancer resin from Garcinia hanburyi. Biomed Chromatogr. 2008 Jun;22(6):637-44. doi: 10.1002/bmc.981. [PubMed:18254140 ]
Song JZ, Yip YK, Han QB, Qiao CF, Xu HX: Rapid determination of polyprenylated xanthones in gamboge resin of Garcinia hanburyi by HPLC. J Sep Sci. 2007 Feb;30(3):304-9. doi: 10.1002/jssc.200600294. [PubMed:17396587 ]
Abbas S, Bhoumik A, Dahl R, Vasile S, Krajewski S, Cosford ND, Ronai ZA: Preclinical studies of celastrol and acetyl isogambogic acid in melanoma. Clin Cancer Res. 2007 Nov 15;13(22 Pt 1):6769-78. doi: 10.1158/1078-0432.CCR-07-1536. [PubMed:18006779 ]

Showing NP-Card for Isogambogic acid (NP0139926)

MOL for NP0139926 (Isogambogic acid)

3D MOL for NP0139926 (Isogambogic acid)

3D SDF for NP0139926 (Isogambogic acid)

3D-SDF for NP0139926 (Isogambogic acid)

PDB for NP0139926 (Isogambogic acid)

3D PDB for NP0139926 (Isogambogic acid)

SMILES for NP0139926 (Isogambogic acid)

INCHI for NP0139926 (Isogambogic acid)

Structure for NP0139926 (Isogambogic acid)

3D Structure for NP0139926 (Isogambogic acid)