propan-2-yl (E)-7-[5-oxidanyl-3-oxidanylidene-2-[(E)-3-oxidanyl-5-phenyl-pent-1-enyl]cyclopentyl]hept-5-enoate

Systemtic Name: propan-2-yl (E)-7-[5-oxidanyl-3-oxidanylidene-2-[(E)-3-oxidanyl-5-phenyl-pent-1-enyl]cyclopentyl]hept-5-enoate Openeye Name: isopropyl (E)-7-[5-hydroxy-2-[(E)-3-hydroxy-5-phenyl-pent-1-enyl]-3-oxo-cyclopentyl]hept-5-enoate CAS Name: (E)-7-[5-hydroxy-2-[(E)-3-hydroxy-5-phenylpent-1-enyl]-3-oxocyclopentyl]-5-heptenoic acid propan-2-yl ester IUPAC Name: propan-2-yl (E)-7-[5-hydroxy-2-[(E)-3-hydroxy-5-phenylpent-1-enyl]-3-oxocyclopentyl]hept-5-enoate Traditional Name: (E)-7-[5-hydroxy-2-[(E)-3-hydroxy-5-phenyl-pent-1-enyl]-3-keto-cyclopentyl]hept-5-enoic acid isopropyl ester Formula: C26H36O5 MolecularWeight: 428.56104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CCCC=CCC1C(CC(=O)C1C=CC(CCC2=CC=CC=C2)O)O

Isomeric SMILES

CC(C)OC(=O)CCC/C=C/CC1C(CC(=O)C1/C=C/C(CCC2=CC=CC=C2)O)O

InChI

InChI=1S/C26H36O5/c1-19(2)31-26(30)13-9-4-3-8-12-22-23(25(29)18-24(22)28)17-16-21(27)15-14-20-10-6-5-7-11-20/h3,5-8,10-11,16-17,19,21-24,27-28H,4,9,12-15,18H2,1-2H3/b8-3+,17-16+