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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H30O5
Molecular Weight 374.4706
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CANNABIELSOIC ACID B

SMILES

CCCCCC1=CC(O)=C2[C@@H]3[C@H](OC2=C1C(O)=O)[C@@](C)(O)CC[C@H]3C(C)=C

InChI

InChIKey=HJMCQDCJBFTRPX-RSGMMRJUSA-N
InChI=1S/C22H30O5/c1-5-6-7-8-13-11-15(23)18-17-14(12(2)3)9-10-22(4,26)20(17)27-19(18)16(13)21(24)25/h11,14,17,20,23,26H,2,5-10H2,1,3-4H3,(H,24,25)/t14-,17+,20-,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H30O5
Molecular Weight 374.4706
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:48:57 GMT 2025
Edited
by admin
on Mon Mar 31 21:48:57 GMT 2025
Record UNII
J66DS78DF7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CBEA-B
Preferred Name English
CANNABIELSOIC ACID B
Common Name English
(5AS,6S,9R,9AR)-5A,6,7,8,9,9A-HEXAHYDRO-1,6-DIHYDROXY-6-METHYL-9-(1-METHYLETHENYL)-3-PENTYL-4-DIBENZOFURANCARBOXYLIC ACID
Systematic Name English
4-DIBENZOFURANCARBOXYLIC ACID, 5A,6,7,8,9,9A-HEXAHYDRO-1,6-DIHYDROXY-6-METHYL-9-(1-METHYLETHENYL)-3-PENTYL-, (5AS-(5A.ALPHA.,6.ALPHA.,9.ALPHA.,9A.ALPHA.))-
Systematic Name English
4-DIBENZOFURANCARBOXYLIC ACID, 5A,6,7,8,9,9A-HEXAHYDRO-1,6-DIHYDROXY-6-METHYL-9-(1-METHYLETHENYL)-3-PENTYL-, (5AS,6S,9R,9AR)-
Common Name English
Code System Code Type Description
FDA UNII
J66DS78DF7
Created by admin on Mon Mar 31 21:48:57 GMT 2025 , Edited by admin on Mon Mar 31 21:48:57 GMT 2025
PRIMARY
PUBCHEM
59444401
Created by admin on Mon Mar 31 21:48:57 GMT 2025 , Edited by admin on Mon Mar 31 21:48:57 GMT 2025
PRIMARY
CAS
55652-62-5
Created by admin on Mon Mar 31 21:48:57 GMT 2025 , Edited by admin on Mon Mar 31 21:48:57 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
Cannabielsoin Class