Molecule ID: 10176229

IUPAC Name: (6R)-2,2,6-trimethylcyclohexane-1,4-dione

Description: The molecule is a member of the class of cyclohexanones that is cyclohexane-1,4-dionecarrying a gem-dimethyl group at position 2 and an additional methyl substituent at position 6 (the R-enantiomer). It has a role as a bacterial metabolite. It derives from a cyclohexane-1,4-dione.

SMILES: C[C@@H]1CC(=O)CC(C)(C)C1=O

SELFIES: [C][C@@H1][C][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][=Branch2][=O]

InChI: InChI=1S/C9H14O2/c1-6-4-7(10)5-9(2,3)8(6)11/h6H,4-5H2,1-3H3/t6-/m1/s1

Molecular Properties:
- Polar Surface Area: 34.1 Ų
- LogP: 0.9