7-[(1S,2S)-2-(5,5-dimethyl-3-oxidanyl-cyclohexen-1-yl)-5-oxidanylidene-cyclopentyl]heptanoic acid

Systemtic Name: 7-[(1S,2S)-2-(5,5-dimethyl-3-oxidanyl-cyclohexen-1-yl)-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 7-[(1S,2S)-2-(3-hydroxy-5,5-dimethyl-cyclohexen-1-yl)-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[(1S,2S)-2-(3-hydroxy-5,5-dimethyl-1-cyclohexenyl)-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[(1S,2S)-2-(3-hydroxy-5,5-dimethylcyclohexen-1-yl)-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[(1S,2S)-2-(3-hydroxy-5,5-dimethyl-cyclohexen-1-yl)-5-keto-cyclopentyl]enanthic acid Formula: C20H32O4 MolecularWeight: 336.46568

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C=C(C1)C2CCC(=O)C2CCCCCCC(=O)O)O)C

Isomeric SMILES

CC1(CC(C=C(C1)[C@H]2CCC(=O)[C@H]2CCCCCCC(=O)O)O)C

InChI

InChI=1S/C20H32O4/c1-20(2)12-14(11-15(21)13-20)16-9-10-18(22)17(16)7-5-3-4-6-8-19(23)24/h11,15-17,21H,3-10,12-13H2,1-2H3,(H,23,24)/t15?,16-,17+/m1/s1