methyl 7-[2-[(E)-4,4-dimethyl-3-oxidanyl-oct-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]-4-oxidanylidene-heptanoate

Systemtic Name: methyl 7-[2-[(E)-4,4-dimethyl-3-oxidanyl-oct-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]-4-oxidanylidene-heptanoate Openeye Name: methyl 7-[3-hydroxy-2-[(E)-3-hydroxy-4,4-dimethyl-oct-1-enyl]-5-oxo-cyclopentyl]-4-oxo-heptanoate CAS Name: 7-[3-hydroxy-2-[(E)-3-hydroxy-4,4-dimethyloct-1-enyl]-5-oxocyclopentyl]-4-oxoheptanoic acid methyl ester IUPAC Name: methyl 7-[3-hydroxy-2-[(E)-3-hydroxy-4,4-dimethyloct-1-enyl]-5-oxocyclopentyl]-4-oxoheptanoate Traditional Name: 7-[3-hydroxy-2-[(E)-3-hydroxy-4,4-dimethyl-oct-1-enyl]-5-keto-cyclopentyl]-4-keto-enanthic acid methyl ester Formula: C23H38O6 MolecularWeight: 410.54422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C(C=CC1C(CC(=O)C1CCCC(=O)CCC(=O)OC)O)O

Isomeric SMILES

CCCCC(C)(C)C(/C=C/C1C(CC(=O)C1CCCC(=O)CCC(=O)OC)O)O

InChI

InChI=1S/C23H38O6/c1-5-6-14-23(2,3)21(27)12-11-18-17(19(25)15-20(18)26)9-7-8-16(24)10-13-22(28)29-4/h11-12,17-18,20-21,26-27H,5-10,13-15H2,1-4H3/b12-11+