NP-MRD: Showing NP-Card for Cannabichromevarinic acid (NP0044834)

Jump To Section:

Identification Spectra BioTaxonomy ChemoTaxonomy Physical properties Links References XML

Record Information

Version

2.0

Created at

2022-03-10 18:36:18 UTC

Updated at

2022-03-10 22:18:49 UTC

NP-MRD ID

NP0044834

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Cannabichromevarinic acid

Description

Cannabichromevarinic acid (CBCVA), a biosynthetic derivative of cannabigerovarinic acid (CBGVA),¬† is a non-psychoactive component of cannabis. CBCVA is a C3 analogue of cannabichromenic acid. CBCVA is one of the more than 100 cannabinoids found in Cannabis sativa plants. As its precursor, cannabigerovarinic acid, CBCVA is a phytocannabinoid that belongs to the class of organic compounds known as hydroxybenzoic acid derivatives. Cannabichromenic acid is characterized by the presence of a chromene (1-benzopyran) moiety in the center of the structure. This chromene arrangement results from the cyclization of the isoprenoid sidechain onto the hydroxyl group in position four of cannabigerovarinic acid, yielding a pyrane type ring. Cannabichromevarinic acid is a molecule of mixed biosynthetic oDOI: Rigin, in which its aromatic moiety (derived from divarinic acid) occurs through the polyketide biosynthetic pathway while the prenylated sidechain derives from the MEP pathway of the terpenoids (DOI: 10.1016/B978-0-12-800756-3.00002-8). As such, cannabichromevarinic acid can be considered a polyketide, a monoterpenoid and a resorcinol, due to the meta arrangement of its two hydroxyl groups on the benzene ring.¬† CBCVA was one of four propyl cannabinoid acids isolated from Thai Cannabis, 'Meao Variant' in 1977 (DOI: 10.1248/Cpb.25.2306).

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 50 51  0  0  0  0  0  0  0  0999 V2000
    6.1611    2.9334    0.4203 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0487    1.9203    0.6940 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4115    1.4802   -0.5997 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3388    0.4692   -0.3500 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0326    0.9568   -0.2809 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9754    0.0822   -0.0013 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2779   -1.2410    0.1961 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5781   -1.7528    0.1311 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6841   -3.0805    0.3531 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6102   -0.8667   -0.1486 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9565   -1.3959   -0.2481 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9659   -0.6989   -0.4967 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1901   -2.7397   -0.0661 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1400   -2.1240    0.4898 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0817   -1.6769    0.5587 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4339   -0.2679    0.3528 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.9821    0.2499    1.6707 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3897   -0.1566   -0.8017 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6643   -0.8658   -0.7724 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5379   -0.4669    0.3342 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6993    0.1369    0.0751 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6321    0.5669    1.1598 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1086    0.4048   -1.3295 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3084    0.5108    0.0753 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0036    2.7448    1.1269 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5558    2.7902   -0.6123 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7661    3.9623    0.5414 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4214    1.1072    1.3051 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2532    2.4369    1.3317 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1328    1.1655   -1.3660 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9326    2.4086   -1.0729 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8186    1.9925   -0.4381 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3361   -3.7712    0.3980 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5549   -3.3156   -0.8294 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3342   -3.1901    0.6545 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8897   -2.4245    0.7884 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1268    0.7628    2.2325 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7340    1.0236    1.5874 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2412   -0.5824    2.3488 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8010   -0.5116   -1.7020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4948    0.9521   -0.9956 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5528   -1.9906   -0.8165 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2435   -0.6695   -1.7379 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3126   -0.6516    1.3479 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4093   -0.2270    1.3015 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0383    0.6475    2.1064 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1124    1.5193    0.9238 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2693   -0.5465   -1.9039 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3589    1.0278   -1.8807 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0572    0.9616   -1.3779 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  2  0
  7 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  1  1
 16 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  2  3
 21 22  1  0
 21 23  1  0
 16 24  1  0
  7  8  1  0
  8  9  1  0
  8 10  2  0
 10 11  1  0
 11 13  1  0
 11 12  2  0
 10  4  1  0
 24  6  1  0
  1 25  1  0
  1 26  1  0
  1 27  1  0
  2 28  1  0
  2 29  1  0
  3 30  1  0
  3 31  1  0
  5 32  1  0
 14 35  1  0
 15 36  1  0
 17 37  1  0
 17 38  1  0
 17 39  1  0
 18 40  1  0
 18 41  1  0
 19 42  1  0
 19 43  1  0
 20 44  1  0
 22 45  1  0
 22 46  1  0
 22 47  1  0
 23 48  1  0
 23 49  1  0
 23 50  1  0
  9 33  1  0
 13 34  1  0
M  END


  Mrv1652307312018212D          

 24 25  0  0  1  0            999 V2000
    4.2868    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1859   -1.3748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4340    0.0325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5269    1.3808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8091    0.3190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0913   -0.4563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9966    0.4623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9037   -0.5995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    1.2375    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.4289    3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  5  1  1  0  0  0  0
  7  5  1  0  0  0  0
  8  6  1  0  0  0  0
 10  6  1  0  0  0  0
 11  9  2  0  0  0  0
 13  2  1  0  0  0  0
 13  3  1  0  0  0  0
 13  8  2  0  0  0  0
 14  7  1  0  0  0  0
 14 12  2  0  0  0  0
 15  9  1  0  0  0  0
 16 12  1  0  0  0  0
 16 15  2  0  0  0  0
 17 14  1  0  0  0  0
 18 15  1  0  0  0  0
 18 17  2  0  0  0  0
 19 17  1  0  0  0  0
 20  4  1  6  0  0  0
 20 10  1  1  0  0  0
 20 11  1  0  0  0  0
 21 18  1  0  0  0  0
 22 19  2  0  0  0  0
 23 19  1  0  0  0  0
 24 16  1  0  0  0  0
 24 20  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0044834

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CCCC1=CC2=C(C=C[C@](C)(CCC=C(C)C)O2)C(O)=C1C(O)=O

> <INCHI_IDENTIFIER>
InChI=1S/C20H26O4/c1-5-7-14-12-16-15(18(21)17(14)19(22)23)9-11-20(4,24-16)10-6-8-13(2)3/h8-9,11-12,21H,5-7,10H2,1-4H3,(H,22,23)/t20-/m0/s1

> <INCHI_KEY>
OIVPAQDCMDYIIL-FQEVSTJZSA-N

> <FORMULA>
C20H26O4

> <MOLECULAR_WEIGHT>
330.424

> <EXACT_MASS>
330.183109317

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_ATOM_COUNT>
50

> <JCHEM_AVERAGE_POLARIZABILITY>
37.09646625228524

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(2S)-5-hydroxy-2-methyl-2-(4-methylpent-3-en-1-yl)-7-propyl-2H-chromene-6-carboxylic acid

> <ALOGPS_LOGP>
5.06

> <JCHEM_LOGP>
6.018113528666666

> <ALOGPS_LOGS>
-4.24

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
2

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
12.428716001915951

> <JCHEM_PKA_STRONGEST_ACIDIC>
2.868164390768602

> <JCHEM_PKA_STRONGEST_BASIC>
-4.93487532067408

> <JCHEM_POLAR_SURFACE_AREA>
66.76

> <JCHEM_REFRACTIVITY>
97.65729999999996

> <JCHEM_ROTATABLE_BOND_COUNT>
6

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.92e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(2S)-5-hydroxy-2-methyl-2-(4-methylpent-3-en-1-yl)-7-propylchromene-6-carboxylic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 31-JUL-20   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   31-JUL-20         0                                  
HETATM    1  C   UNK     0       8.002   1.540   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -5.947  -2.566   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -6.410   0.061   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -2.850   2.577   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       6.668   2.310   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -3.377   0.595   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       5.335   1.540   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -3.904  -0.852   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       0.000   4.620   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -1.860   0.863   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -1.334   3.850   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       2.667   1.540   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -5.420  -1.119   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       4.001   2.310   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       1.334   3.850   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       1.334   2.310   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       4.001   3.850   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       2.667   4.620   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       5.335   4.620   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      -1.334   2.310   0.000  0.00  0.00           C+0
HETATM   21  O   UNK     0       2.667   6.160   0.000  0.00  0.00           O+0
HETATM   22  O   UNK     0       5.335   6.160   0.000  0.00  0.00           O+0
HETATM   23  O   UNK     0       6.668   3.850   0.000  0.00  0.00           O+0
HETATM   24  O   UNK     0       0.000   1.540   0.000  0.00  0.00           O+0
CONECT    1    5                                                            
CONECT    2   13                                                            
CONECT    3   13                                                            
CONECT    4   20                                                            
CONECT    5    1    7                                                       
CONECT    6    8   10                                                       
CONECT    7    5   14                                                       
CONECT    8    6   13                                                       
CONECT    9   11   15                                                       
CONECT   10    6   20                                                       
CONECT   11    9   20                                                       
CONECT   12   14   16                                                       
CONECT   13    2    3    8                                                  
CONECT   14    7   12   17                                                  
CONECT   15    9   16   18                                                  
CONECT   16   12   15   24                                                  
CONECT   17   14   18   19                                                  
CONECT   18   15   17   21                                                  
CONECT   19   17   22   23                                                  
CONECT   20    4   10   11   24                                             
CONECT   21   18                                                            
CONECT   22   19                                                            
CONECT   23   19                                                            
CONECT   24   16   20                                                       
MASTER        0    0    0    0    0    0    0    0   24    0   50    0
END

View in JSmol

Synonyms

Value	Source
(2S)-5-Hydroxy-2-methyl-2-(4-methylpent-3-en-1-yl)-7-propyl-2H-chromene-6-carboxylate	Generator

Chemical Formula

C₂₀H₂₆O₄

Average Mass

330.4240 Da

Monoisotopic Mass

330.18311 Da

IUPAC Name

(2S)-5-hydroxy-2-methyl-2-(4-methylpent-3-en-1-yl)-7-propyl-2H-chromene-6-carboxylic acid

Traditional Name

(2S)-5-hydroxy-2-methyl-2-(4-methylpent-3-en-1-yl)-7-propylchromene-6-carboxylic acid

CAS Registry Number

64898-02-8

SMILES

CCCC1=CC2=C(C=C[C@](C)(CCC=C(C)C)O2)C(O)=C1C(O)=O

InChI Identifier

InChI=1S/C20H26O4/c1-5-7-14-12-16-15(18(21)17(14)19(22)23)9-11-20(4,24-16)10-6-8-13(2)3/h8-9,11-12,21H,5-7,10H2,1-4H3,(H,22,23)/t20-/m0/s1

InChI Key

OIVPAQDCMDYIIL-FQEVSTJZSA-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, 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
Cannabis sativa	NULL	Not Available

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as salicylic acid and derivatives. Salicylic acid and derivatives are compounds containing a 2-hydroxybenzoic acid moiety or a derivative thereof.

Kingdom

Organic compounds

Super Class

Benzenoids

Class

Benzene and substituted derivatives

Sub Class

Benzoic acids and derivatives

Direct Parent

Salicylic acid and derivatives

Alternative Parents

Substituents

1-benzopyran
Salicylic acid or derivatives
Benzopyran
1-hydroxy-4-unsubstituted benzenoid
Alkyl aryl ether
Vinylogous acid
Oxacycle
Organoheterocyclic compound
Monocarboxylic acid or derivatives
Ether
Carboxylic acid
Carboxylic acid derivative
Organic oxygen compound
Organic oxide
Hydrocarbon derivative
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
logP	5.06	ALOGPS
logP	6.02	ChemAxon
logS	-4.2	ALOGPS
pKa (Strongest Acidic)	2.87	ChemAxon
pKa (Strongest Basic)	-4.9	ChemAxon
Physiological Charge	-1	ChemAxon
Hydrogen Acceptor Count	4	ChemAxon
Hydrogen Donor Count	2	ChemAxon
Polar Surface Area	66.76 Å²	ChemAxon
Rotatable Bond Count	6	ChemAxon
Refractivity	97.66 m³·mol⁻¹	ChemAxon
Polarizability	37.1 Å³	ChemAxon
Number of Rings	2	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

Not Available

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Not Available

Showing NP-Card for Cannabichromevarinic acid (NP0044834)

MOL for NP0044834 (Cannabichromevarinic acid)

3D MOL for NP0044834 (Cannabichromevarinic acid)

3D SDF for NP0044834 (Cannabichromevarinic acid)

3D-SDF for NP0044834 (Cannabichromevarinic acid)

PDB for NP0044834 (Cannabichromevarinic acid)

3D PDB for NP0044834 (Cannabichromevarinic acid)

SMILES for NP0044834 (Cannabichromevarinic acid)

INCHI for NP0044834 (Cannabichromevarinic acid)

Structure for NP0044834 (Cannabichromevarinic acid)

3D Structure for NP0044834 (Cannabichromevarinic acid)