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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H28O4
Molecular Weight 344.4446
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-CARBOXYCANNABIDIOL

SMILES

CCCCCC1=CC(O)=C([C@@H]2C=C(CC[C@H]2C(C)=C)C(O)=O)C(O)=C1

InChI

InChIKey=LQHAPFLIUQWVJR-DLBZAZTESA-N
InChI=1S/C21H28O4/c1-4-5-6-7-14-10-18(22)20(19(23)11-14)17-12-15(21(24)25)8-9-16(17)13(2)3/h10-12,16-17,22-23H,2,4-9H2,1,3H3,(H,24,25)/t16-,17+/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H28O4
Molecular Weight 344.4446
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:28:07 UTC 2023
Edited
by admin
on Sat Dec 16 14:28:07 UTC 2023
Record UNII
9S6E5L3ZXA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7-CARBOXYCANNABIDIOL
Common Name English
CANNABIDIOL-11-OIC ACID
Common Name English
CANNABIDIOL METABOLITE (7-CARBOXYCANNABIDIOL)
Common Name English
1-CYCLOHEXENE-1-CARBOXYLIC ACID, 3-(2,6-DIHYDROXY-4-PENTYLPHENYL)-4-(1-METHYLETHENYL)-, (3R,4R)-
Common Name English
Code System Code Type Description
PUBCHEM
146592489
Created by admin on Sat Dec 16 14:28:07 UTC 2023 , Edited by admin on Sat Dec 16 14:28:07 UTC 2023
PRIMARY
CAS
63958-77-0
Created by admin on Sat Dec 16 14:28:07 UTC 2023 , Edited by admin on Sat Dec 16 14:28:07 UTC 2023
PRIMARY
FDA UNII
9S6E5L3ZXA
Created by admin on Sat Dec 16 14:28:07 UTC 2023 , Edited by admin on Sat Dec 16 14:28:07 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE INACTIVE
The major circulating metabolites include 7-carboxy-cannabidiol (7-COOH-CBD), which was approximately 40-fold higher than the parent.
MAJOR