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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H30O3
Molecular Weight 330.4619
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CANNABIELSOIN

SMILES

CCCCCc1cc(c2c(c1)O[C@@]3([H])[C@]2([H])[C@@]([H])(CC[C@]3(C)O)C(=C)C)O

InChI

InChIKey=RBEAVAMWZAJWOI-MTOHEIAKSA-N
InChI=1S/C21H30O3/c1-5-6-7-8-14-11-16(22)19-17(12-14)24-20-18(19)15(13(2)3)9-10-21(20,4)23/h11-12,15,18,20,22-23H,2,5-10H2,1,3-4H3/t15-,18+,20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H30O3
Molecular Weight 330.4619
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 Sat Jun 26 04:25:11 UTC 2021
Edited
by admin
on Sat Jun 26 04:25:11 UTC 2021
Record UNII
2ERD6V6652
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CANNABIELSOIN
Common Name English
CANNABIELSOIN I
Common Name English
CANNABIELSOIN A
Common Name English
CBE
Code English
1,6-DIBENZOFURANDIOL, 5A,6,7,8,9,9A-HEXAHYDRO-6-METHYL-9-(1-METHYLETHENYL)-3-PENTYL-, (5AS-(5A.ALPHA.,6.ALPHA.,9.ALPHA.,9A.ALPHA.))-
Systematic Name English
1,6-DIBENZOFURANDIOL, 5A,6,7,8,9,9A-HEXAHYDRO-6-METHYL-9-(1-METHYLETHENYL)-3-PENTYL-, (5AS,6S,9R,9AR)-
Common Name English
Code System Code Type Description
FDA UNII
2ERD6V6652
Created by admin on Sat Jun 26 04:25:11 UTC 2021 , Edited by admin on Sat Jun 26 04:25:11 UTC 2021
PRIMARY
CAS
52025-76-0
Created by admin on Sat Jun 26 04:25:11 UTC 2021 , Edited by admin on Sat Jun 26 04:25:11 UTC 2021
PRIMARY
PUBCHEM
162113
Created by admin on Sat Jun 26 04:25:11 UTC 2021 , Edited by admin on Sat Jun 26 04:25:11 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
Cannabielsoin Class