(2R)-4-[(1S,2S,6S)-2,6-dimethyl-2-oxidanyl-5-oxidanylidene-cyclohexyl]-2-methyl-butanoic acid

Systemtic Name: (2R)-4-[(1S,2S,6S)-2,6-dimethyl-2-oxidanyl-5-oxidanylidene-cyclohexyl]-2-methyl-butanoic acid Openeye Name: (2R)-4-[(1S,2S,6S)-2-hydroxy-2,6-dimethyl-5-oxo-cyclohexyl]-2-methyl-butanoic acid CAS Name: (2R)-4-[(1S,2S,6S)-2-hydroxy-2,6-dimethyl-5-oxocyclohexyl]-2-methylbutanoic acid IUPAC Name: (2R)-4-[(1S,2S,6S)-2-hydroxy-2,6-dimethyl-5-oxocyclohexyl]-2-methylbutanoic acid Traditional Name: (2R)-4-[(1S,2S,6S)-2-hydroxy-5-keto-2,6-dimethyl-cyclohexyl]-2-methyl-butyric acid Formula: C13H22O4 MolecularWeight: 242.31138

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CCC1=O)(C)O)CCC(C)C(=O)O

Isomeric SMILES

C[C@H]1[C@@H]([C@@](CCC1=O)(C)O)CC[C@@H](C)C(=O)O

InChI

InChI=1S/C13H22O4/c1-8(12(15)16)4-5-10-9(2)11(14)6-7-13(10,3)17/h8-10,17H,4-7H2,1-3H3,(H,15,16)/t8-,9+,10+,13+/m1/s1