NP-MRD: Showing NP-Card for Ginkgoneolic acid (NP0084808)

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Record Information

Version

2.0

Created at

2022-04-29 05:27:01 UTC

Updated at

2022-04-29 05:27:02 UTC

NP-MRD ID

NP0084808

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Ginkgoneolic acid

Description

2-Hydroxy-6-tridecylbenzoic acid, also known as 6-N-tridecylsalicylic acid or 6-tridecyl phenol, belongs to the class of organic compounds known as salicylic acids. These are ortho-hydroxylated benzoic acids. 2-Hydroxy-6-tridecylbenzoic acid is an extremely weak basic (essentially neutral) compound (based on its pKa). Outside of the human body, 2-Hydroxy-6-tridecylbenzoic acid has been detected, but not quantified in, fats and oils and nuts. Ginkgoneolic acid is found in Caulocystis cephalornithos and Ginkgo biloba . This could make 2-hydroxy-6-tridecylbenzoic acid a potential biomarker for the consumption of these foods.

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 55 55  0  0  0  0  0  0  0  0999 V2000
    8.2833    1.1741   -0.3152 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6364   -0.1383   -0.0082 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1472   -0.1373   -0.2133 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4416    0.8685    0.6479 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9708    0.8209    0.3991 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3543   -0.5146    0.6934 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8543   -0.3911    0.3877 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2480   -1.7220    0.6825 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2428   -1.7809    0.4412 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5600   -1.4772   -0.9948 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0281   -1.5345   -1.3212 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7617   -0.5133   -0.4775 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2481   -0.5269   -0.7856 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9379    0.4917    0.0365 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2339    1.2918    0.9392 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8310    2.2504    1.7315 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2132    2.4215    1.6164 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9336    1.6570    0.7436 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2932    1.8100    0.6158 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3059    0.6919   -0.0489 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1075   -0.0966   -0.9717 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3507    0.0785   -1.0636 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5456   -1.0533   -1.7718 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3937    0.9902   -0.3417 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0170    1.6017   -1.2887 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1248    1.8679    0.5381 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0563   -0.9068   -0.7050 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9357   -0.4475    1.0023 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7791   -1.1489    0.0558 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9138    0.0472   -1.2625 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6483    0.7123    1.7283 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7932    1.8938    0.4135 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7944    1.0311   -0.6941 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4311    1.5867    0.9903 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4389   -0.8132    1.7394 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7431   -1.2450   -0.0324 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7750   -0.1080   -0.6818 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3838    0.4018    0.9946 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4399   -1.9978    1.7341 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7119   -2.4630   -0.0092 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7865   -1.1361    1.1467 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5732   -2.8319    0.6266 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0397   -2.1258   -1.6888 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1459   -0.4441   -1.1903 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4500   -2.5435   -1.2107 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1566   -1.1746   -2.3846 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6540   -0.7279    0.6061 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3710    0.4813   -0.7406 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3649   -0.2614   -1.8523 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6566   -1.5488   -0.6108 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1489    1.1441    1.0097 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2355    2.8424    2.4147 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6595    3.1800    2.2489 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7614    2.5033    1.1816 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7986   -2.0294   -1.7921 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  1  0
  5  6  1  0
  6  7  1  0
  7  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 20  2  0
 20 21  1  0
 21 23  1  0
 21 22  2  0
 20 18  1  0
 18 19  1  0
 18 17  2  0
 17 16  1  0
 16 15  2  0
 15 14  1  0
  1 24  1  0
  1 25  1  0
  1 26  1  0
  2 27  1  0
  2 28  1  0
  3 29  1  0
  3 30  1  0
  4 31  1  0
  4 32  1  0
  5 33  1  0
  5 34  1  0
  6 35  1  0
  6 36  1  0
  7 37  1  0
  7 38  1  0
  8 39  1  0
  8 40  1  0
  9 41  1  0
  9 42  1  0
 10 43  1  0
 10 44  1  0
 11 45  1  0
 11 46  1  0
 12 47  1  0
 12 48  1  0
 13 49  1  0
 13 50  1  0
 23 55  1  0
 19 54  1  0
 17 53  1  0
 16 52  1  0
 15 51  1  0
M  END


  Mrv0541 05061310302D          

 23 23  0  0  0  0            999 V2000
    7.8592   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5737   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2881   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0026   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7171   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4315   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1460   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8605   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5749   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2894   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0039   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7184   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5762   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4328   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8618   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5762   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1473   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8618   -2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1473   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4328   -2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8618   -2.8875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.4328   -2.8875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7184   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 14 12  1  0  0  0  0
 15 13  2  0  0  0  0
 16 13  1  0  0  0  0
 17 14  1  0  0  0  0
 17 15  1  0  0  0  0
 18 16  2  0  0  0  0
 19 17  2  0  0  0  0
 19 18  1  0  0  0  0
 20 19  1  0  0  0  0
 21 18  1  0  0  0  0
 22 20  2  0  0  0  0
 23 20  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0084808

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CCCCCCCCCCCCCC1=C(C(O)=O)C(O)=CC=C1

> <INCHI_IDENTIFIER>
InChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-14-17-15-13-16-18(21)19(17)20(22)23/h13,15-16,21H,2-12,14H2,1H3,(H,22,23)

> <INCHI_KEY>
VEPUCZUJLKAVNM-UHFFFAOYSA-N

> <FORMULA>
C20H32O3

> <MOLECULAR_WEIGHT>
320.4663

> <EXACT_MASS>
320.23514489

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_AVERAGE_POLARIZABILITY>
39.85827365841311

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
2-hydroxy-6-tridecylbenzoic acid

> <ALOGPS_LOGP>
7.24

> <JCHEM_LOGP>
7.825508771666667

> <ALOGPS_LOGS>
-5.45

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
13.364273313398293

> <JCHEM_PKA_STRONGEST_ACIDIC>
2.6407335510874566

> <JCHEM_PKA_STRONGEST_BASIC>
-6.287065354678245

> <JCHEM_POLAR_SURFACE_AREA>
57.53

> <JCHEM_REFRACTIVITY>
95.54829999999997

> <JCHEM_ROTATABLE_BOND_COUNT>
13

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.13e-03 g/l

> <JCHEM_TRADITIONAL_IUPAC>
2-hydroxy-6-tridecylbenzoic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 06-MAY-13   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-MAY-13         0                                  
HETATM    1  C   UNK     0      14.671  -0.770   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      16.004  -1.540   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      17.338  -0.770   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      18.672  -1.540   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      20.005  -0.770   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      21.339  -1.540   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      22.673  -0.770   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      24.006  -1.540   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      25.340  -0.770   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      26.674  -1.540   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      28.007  -0.770   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      29.341  -1.540   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      34.676  -1.540   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      30.675  -0.770   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      33.342  -0.770   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      34.676  -3.080   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      32.008  -1.540   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      33.342  -3.850   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      32.008  -3.080   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      30.675  -3.850   0.000  0.00  0.00           C+0
HETATM   21  O   UNK     0      33.342  -5.390   0.000  0.00  0.00           O+0
HETATM   22  O   UNK     0      30.675  -5.390   0.000  0.00  0.00           O+0
HETATM   23  O   UNK     0      29.341  -3.080   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5    7                                                       
CONECT    7    6    8                                                       
CONECT    8    7    9                                                       
CONECT    9    8   10                                                       
CONECT   10    9   11                                                       
CONECT   11   10   12                                                       
CONECT   12   11   14                                                       
CONECT   13   15   16                                                       
CONECT   14   12   17                                                       
CONECT   15   13   17                                                       
CONECT   16   13   18                                                       
CONECT   17   14   15   19                                                  
CONECT   18   16   19   21                                                  
CONECT   19   17   18   20                                                  
CONECT   20   19   22   23                                                  
CONECT   21   18                                                            
CONECT   22   20                                                            
CONECT   23   20                                                            
MASTER        0    0    0    0    0    0    0    0   23    0   46    0
END

View in JSmol

Synonyms

Value	Source
2-Hydroxy-6-tridecylbenzoate	Generator
6-Tridecyl phenol	HMDB
2-Hydroxy-6-tridecyl-benzoic acid	HMDB
6-N-Tridecylsalicylic acid	HMDB
6-Tridecyl-salicylic acid	HMDB
6-Tridecylsalicylic acid	HMDB
Salicylic acid, 6-tridecyl- (8ci)	HMDB
6-N-TDSCA	MeSH

Chemical Formula

C₂₀H₃₂O₃

Average Mass

320.4663 Da

Monoisotopic Mass

320.23514 Da

IUPAC Name

2-hydroxy-6-tridecylbenzoic acid

Traditional Name

2-hydroxy-6-tridecylbenzoic acid

CAS Registry Number

Not Available

SMILES

CCCCCCCCCCCCCC1=C(C(O)=O)C(O)=CC=C1

InChI Identifier

InChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-14-17-15-13-16-18(21)19(17)20(22)23/h13,15-16,21H,2-12,14H2,1H3,(H,22,23)

InChI Key

VEPUCZUJLKAVNM-UHFFFAOYSA-N

Experimental Spectra

Spectrum Type	Description	Depositor Email	Depositor Organization	Depositor	Deposition Date	View
1D NMR	¹H NMR Spectrum (1D, 600.17 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	¹³C NMR Spectrum (1D, 25 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
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, 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	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, 300 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, 400 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	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, 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	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, 700 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, 800 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
1D NMR	¹H NMR Spectrum (1D, 900 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
Caulocystis cephalornithos	LOTUS Database	35616633
Ginkgo biloba	Plant	KNApSAcK

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as salicylic acids. These are ortho-hydroxylated benzoic acids.

Kingdom

Organic compounds

Super Class

Benzenoids

Class

Benzene and substituted derivatives

Sub Class

Benzoic acids and derivatives

Direct Parent

Salicylic acids

Alternative Parents

Substituents

Salicylic acid
Benzoic acid
Benzoyl
1-hydroxy-4-unsubstituted benzenoid
1-hydroxy-2-unsubstituted benzenoid
Phenol
Vinylogous acid
Monocarboxylic acid or derivatives
Carboxylic acid
Carboxylic acid derivative
Organic oxygen compound
Organic oxide
Hydrocarbon derivative
Organooxygen compound
Aromatic homomonocyclic compound

Molecular Framework

Aromatic homomonocyclic 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	7.24	ALOGPS
logP	7.83	ChemAxon
logS	-5.4	ALOGPS
pKa (Strongest Acidic)	2.64	ChemAxon
pKa (Strongest Basic)	-6.3	ChemAxon
Physiological Charge	-1	ChemAxon
Hydrogen Acceptor Count	3	ChemAxon
Hydrogen Donor Count	2	ChemAxon
Polar Surface Area	57.53 Å²	ChemAxon
Rotatable Bond Count	13	ChemAxon
Refractivity	95.55 m³·mol⁻¹	ChemAxon
Polarizability	39.86 Å³	ChemAxon
Number of Rings	1	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

External Links

HMDB ID

HMDB0038520

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

FDB017903

KNApSAcK ID

Not Available

Chemspider ID

141696

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

161306

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Not Available

Showing NP-Card for Ginkgoneolic acid (NP0084808)

MOL for NP0084808 (Ginkgoneolic acid)

3D MOL for NP0084808 (Ginkgoneolic acid)

3D SDF for NP0084808 (Ginkgoneolic acid)

3D-SDF for NP0084808 (Ginkgoneolic acid)

PDB for NP0084808 (Ginkgoneolic acid)

3D PDB for NP0084808 (Ginkgoneolic acid)

SMILES for NP0084808 (Ginkgoneolic acid)

INCHI for NP0084808 (Ginkgoneolic acid)

Structure for NP0084808 (Ginkgoneolic acid)

3D Structure for NP0084808 (Ginkgoneolic acid)