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Chemical structure of 8β,9β-epoxy Hexahydrocannabinol

GC91937

8β,9β-epoxy Hexahydrocannabinol

Also known as (1R,10R,12R,14S)-9,9,14-trimethyl-5-pentyl-8,13-dioxatetracyclo[8.5.0.02,7.012,14]pentadeca-2,4,6-trien-3-ol

8β,9β-epoxy Hexahydrocannabinol is an analytical reference standard categorized as a phytocannabinoid metabolite

ChemicalCAS64783-83-1MW330.5FormulaC21H30O3
CAS number
64783-83-1
Molecular weight
330.5
Formula
C21H30O3
Solubility
Acetonitrile: Sparingly soluble: 1–10 mg/ml
InChIKey
DIZIBWOZVJVYLY-YOZRSPHLSA-N
Catalogue number
GC91937
Brand
GLPBIO
Computed properties PubChem CID 101167650 · XLogP 5.1 · TPSA 42 Ų · H-bond donors 1
XLogP
5.1
TPSA
42 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
24

SMILES CCCCCC1=CC(=C2[C@@H]3C[C@]4([C@H](O4)C[C@H]3C(OC2=C1)(C)C)C)O

Computed descriptors from PubChem (CID 101167650), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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