(+)-menthol   Click here for help

GtoPdb Ligand ID: 2471

Compound class: Synthetic organic
Comment: One of the enantiomers in INN-assigned compound racementhol.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 1
Topological polar surface area 20.23
Molecular weight 156.15
XLogP 3.21
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES CC1CCC(C(C1)O)C(C)C
Isomeric SMILES C[C@H]1CC[C@@H]([C@H](C1)O)C(C)C
InChI InChI=1S/C10H20O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-11H,4-6H2,1-3H3/t8-,9+,10-/m0/s1
InChI Key NOOLISFMXDJSKH-AEJSXWLSSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexan-1-ol
International Nonproprietary Names Click here for help
INN number INN
6724 racementhol
Database Links Click here for help
ChEMBL Ligand CHEMBL2106989
GtoPdb PubChem SID 135650579
PubChem CID 165675
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