carveol   

GtoPdb Ligand ID: 6417

Synonyms: L-carveol
2D Structure
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Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 1
Topological polar surface area 20.23
Molecular weight 152.12
XLogP 1.7
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Canonical SMILES CC(=C)C1CC=C(C(C1)O)C
Isomeric SMILES CC(=C)C1CC=C(C(C1)O)C
InChI InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9-11H,1,5-6H2,2-3H3
InChI Key BAVONGHXFVOKBV-UHFFFAOYSA-N
Classification
Compound class Natural product or derivative
IUPAC Name
2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-ol
Synonyms
L-carveol
Database Links
CAS Registry No. 99-48-9 (source: SciFinder)
ChEBI CHEBI:23046
ChEMBL Ligand CHEMBL1385229
GtoPdb PubChem SID 178103033
PubChem CID 7438
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Wikipedia Carveol