U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry UNKNOWN
Molecular Formula C21H30O3
Molecular Weight 330.4611
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4''-HYDROXYCANNABIDIOL

SMILES

CC(O)CCCC1=CC(O)=C([C@@H]2C=C(C)CC[C@H]2C(C)=C)C(O)=C1

InChI

InChIKey=UZIVICVRBBCBHK-XSRYCBBQSA-N
InChI=1S/C21H30O3/c1-13(2)17-9-8-14(3)10-18(17)21-19(23)11-16(12-20(21)24)7-5-6-15(4)22/h10-12,15,17-18,22-24H,1,5-9H2,2-4H3/t15?,17-,18+/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H30O3
Molecular Weight 330.4611
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 2 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:23:41 GMT 2023
Edited
by admin
on Sat Dec 16 14:23:41 GMT 2023
Record UNII
WA854NP548
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4''-HYDROXYCANNABIDIOL
Common Name English
CANNABIDIOL METABOLITE (4''-HYDROXYCANNABIDIOL)
Common Name English
1,3-BENZENEDIOL, 5-(4-HYDROXYPENTYL)-2-(3-METHYL-6-(1-METHYLETHENYL)-2-CYCLOHEXEN-1-YL)-
Common Name English
5-(4-HYDROXYPENTYL)-2-(3-METHYL-6-(1-METHYLETHENYL)-2-CYCLOHEXEN-1-YL)-1,3-BENZENEDIOL
Common Name English
Code System Code Type Description
FDA UNII
WA854NP548
Created by admin on Sat Dec 16 14:23:41 GMT 2023 , Edited by admin on Sat Dec 16 14:23:41 GMT 2023
PRIMARY
PUBCHEM
53357352
Created by admin on Sat Dec 16 14:23:41 GMT 2023 , Edited by admin on Sat Dec 16 14:23:41 GMT 2023
PRIMARY
CAS
59877-46-2
Created by admin on Sat Dec 16 14:23:41 GMT 2023 , Edited by admin on Sat Dec 16 14:23:41 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
MINOR