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

Systemtic Name: methyl 7-[3-oxidanyl-5-oxidanylidene-2-[(E)-3-oxidanyl-2-phenyl-oct-1-enyl]cyclopentyl]heptanoate Openeye Name: methyl 7-[3-hydroxy-2-[(E)-3-hydroxy-2-phenyl-oct-1-enyl]-5-oxo-cyclopentyl]heptanoate CAS Name: 7-[3-hydroxy-2-[(E)-3-hydroxy-2-phenyloct-1-enyl]-5-oxocyclopentyl]heptanoic acid methyl ester IUPAC Name: methyl 7-[3-hydroxy-2-[(E)-3-hydroxy-2-phenyloct-1-enyl]-5-oxocyclopentyl]heptanoate Traditional Name: 7-[3-hydroxy-2-[(E)-3-hydroxy-2-phenyl-oct-1-enyl]-5-keto-cyclopentyl]enanthic acid methyl ester Formula: C27H40O5 MolecularWeight: 444.6035

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=CC1C(CC(=O)C1CCCCCCC(=O)OC)O)C2=CC=CC=C2)O

Isomeric SMILES

CCCCCC(/C(=C/C1C(CC(=O)C1CCCCCCC(=O)OC)O)/C2=CC=CC=C2)O

InChI

InChI=1S/C27H40O5/c1-3-4-8-16-24(28)22(20-13-9-7-10-14-20)18-23-21(25(29)19-26(23)30)15-11-5-6-12-17-27(31)32-2/h7,9-10,13-14,18,21,23-24,26,28,30H,3-6,8,11-12,15-17,19H2,1-2H3/b22-18+