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

Details

Stereochemistry ABSOLUTE
Molecular Formula C20H28O4
Molecular Weight 332.4339
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CANNABICHROMANON

SMILES

CCCCCC1=CC2=C(C(=O)[C@@H](CCC(C)=O)C(C)(C)O2)C(O)=C1

InChI

InChIKey=NHZMSIOYBVIOAF-OAHLLOKOSA-N
InChI=1S/C20H28O4/c1-5-6-7-8-14-11-16(22)18-17(12-14)24-20(3,4)15(19(18)23)10-9-13(2)21/h11-12,15,22H,5-10H2,1-4H3/t15-/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H28O4
Molecular Weight 332.4339
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:23:26 UTC 2023
Edited
by admin
on Sat Dec 16 09:23:26 UTC 2023
Record UNII
CVK7769BHC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CANNABICHROMANON
Common Name English
CBCN
Code English
4H-1-BENZOPYRAN-4-ONE, 2,3-DIHYDRO-5-HYDROXY-2,2-DIMETHYL-3-(3-OXOBUTYL)-7-PENTYL-, (3S)-
Systematic Name English
(3S)-2,3-DIHYDRO-5-HYDROXY-2,2-DIMETHYL-3-(3-OXOBUTYL)-7-PENTYL-4H-1-BENZOPYRAN-4-ONE
Systematic Name English
Code System Code Type Description
FDA UNII
CVK7769BHC
Created by admin on Sat Dec 16 09:23:26 UTC 2023 , Edited by admin on Sat Dec 16 09:23:26 UTC 2023
PRIMARY
CAS
85700-57-8
Created by admin on Sat Dec 16 09:23:26 UTC 2023 , Edited by admin on Sat Dec 16 09:23:26 UTC 2023
PRIMARY
PUBCHEM
25105340
Created by admin on Sat Dec 16 09:23:26 UTC 2023 , Edited by admin on Sat Dec 16 09:23:26 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT