methyl (E)-7-[2-[(1E,5E)-6-cyclopentyl-4-methyl-4-oxidanyl-hexa-1,5-dienyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]hept-2-enoate

Systemtic Name: methyl (E)-7-[2-[(1E,5E)-6-cyclopentyl-4-methyl-4-oxidanyl-hexa-1,5-dienyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]hept-2-enoate Openeye Name: methyl (E)-7-[2-[(1E,5E)-6-cyclopentyl-4-hydroxy-4-methyl-hexa-1,5-dienyl]-3-hydroxy-5-oxo-cyclopentyl]hept-2-enoate CAS Name: (E)-7-[2-[(1E,5E)-6-cyclopentyl-4-hydroxy-4-methylhexa-1,5-dienyl]-3-hydroxy-5-oxocyclopentyl]-2-heptenoic acid methyl ester IUPAC Name: methyl (E)-7-[2-[(1E,5E)-6-cyclopentyl-4-hydroxy-4-methylhexa-1,5-dienyl]-3-hydroxy-5-oxocyclopentyl]hept-2-enoate Traditional Name: (E)-7-[2-[(1E,5E)-6-cyclopentyl-4-hydroxy-4-methyl-hexa-1,5-dienyl]-3-hydroxy-5-keto-cyclopentyl]hept-2-enoic acid methyl ester Formula: C25H38O5 MolecularWeight: 418.56622

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=CC1C(CC(=O)C1CCCCC=CC(=O)OC)O)(C=CC2CCCC2)O

Isomeric SMILES

CC(C/C=C/C1C(CC(=O)C1CCCC/C=C/C(=O)OC)O)(/C=C/C2CCCC2)O

InChI

InChI=1S/C25H38O5/c1-25(29,17-15-19-10-7-8-11-19)16-9-13-21-20(22(26)18-23(21)27)12-5-3-4-6-14-24(28)30-2/h6,9,13-15,17,19-21,23,27,29H,3-5,7-8,10-12,16,18H2,1-2H3/b13-9+,14-6+,17-15+