8alpha-3-Copaen-8-ol

HCID 577203

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Basic information

CAS: 58569-25-8
Standard SMILES: CC1=CCC2C3C(C(C)C)C(O)CC2(C)C13
InChIKey: BVCNHEVITXGCEP-UHFFFAOYSA-N
Molecular formula: C15H24O
Average molar mass: 220.35 g/mol
Monoisotopic mass: 220.18271539

Overview

8alpha-3-Copaen-8-ol is a sesquiterpenoid.

Names & identifiers

Preferred name: 8alpha-3-Copaen-8-ol
IUPAC: 2,8-dimethyl-5-propan-2-yltricyclo[4.4.0.02,7]dec-8-en-4-ol

Names & synonyms

8alpha-3-Copaen-8-olalpha-Copaen-8-ol2,8-dimethyl-5-propan-2-yltricyclo[4.4.0.02,7]dec-8-en-4-olcis-.alpha.-Copaene-8-olSCHEMBL13627132BVCNHEVITXGCEP-UHFFFAOYSA-NCHEBI:195984Q678796682,8-dimethyl-5-(propan-2-yl)tricyclo[4.4.0.0^{2,7}]dec-8-en-4-olTricyclo[4.4.0.0(2,7)]dec-8-en-4-ol, 2,8-dimethyl-5-(1-methylethyl)-, stereoisomer

Database identifiers

CAS: 58569-25-8
PubChem CID: 577203
ChEBI: CHEBI:195984
Nikkaji: J2.575.193K

Properties

Computed structural properties

XLogP: 3.1
Topological polar surface area: 20.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 16
Formal charge: 0
Complexity: 343

Chemistry & industry

Pharmacology

Cellular LocationsCytoplasm

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