methyl 7-[5-acetyloxy-2-(3-acetyloxy-4-phenylsulfanyl-butyl)-3-oxidanylidene-cyclopentyl]heptanoate

Systemtic Name: methyl 7-[5-acetyloxy-2-(3-acetyloxy-4-phenylsulfanyl-butyl)-3-oxidanylidene-cyclopentyl]heptanoate Openeye Name: methyl 7-[5-acetoxy-2-(3-acetoxy-4-phenylsulfanyl-butyl)-3-oxo-cyclopentyl]heptanoate CAS Name: 7-[5-acetyloxy-2-[3-acetyloxy-4-(phenylthio)butyl]-3-oxocyclopentyl]heptanoic acid methyl ester IUPAC Name: methyl 7-[5-acetyloxy-2-(3-acetyloxy-4-phenylsulfanylbutyl)-3-oxocyclopentyl]heptanoate Traditional Name: 7-[5-acetoxy-2-[3-acetoxy-4-(phenylthio)butyl]-3-keto-cyclopentyl]enanthic acid methyl ester Formula: C27H38O7S MolecularWeight: 506.65142

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(=O)C(C1CCCCCCC(=O)OC)CCC(CSC2=CC=CC=C2)OC(=O)C

Isomeric SMILES

CC(=O)OC1CC(=O)C(C1CCCCCCC(=O)OC)CCC(CSC2=CC=CC=C2)OC(=O)C

InChI

InChI=1S/C27H38O7S/c1-19(28)33-21(18-35-22-11-7-6-8-12-22)15-16-23-24(26(17-25(23)30)34-20(2)29)13-9-4-5-10-14-27(31)32-3/h6-8,11-12,21,23-24,26H,4-5,9-10,13-18H2,1-3H3