propyl (E)-7-[3,5-bis(oxidanyl)-2-(3-oxidanyl-5-phenyl-pentyl)cyclopentyl]hept-5-enoate

Systemtic Name: propyl (E)-7-[3,5-bis(oxidanyl)-2-(3-oxidanyl-5-phenyl-pentyl)cyclopentyl]hept-5-enoate Openeye Name: propyl (E)-7-[3,5-dihydroxy-2-(3-hydroxy-5-phenyl-pentyl)cyclopentyl]hept-5-enoate CAS Name: (E)-7-[3,5-dihydroxy-2-(3-hydroxy-5-phenylpentyl)cyclopentyl]-5-heptenoic acid propyl ester IUPAC Name: propyl (E)-7-[3,5-dihydroxy-2-(3-hydroxy-5-phenylpentyl)cyclopentyl]hept-5-enoate Traditional Name: (E)-7-[3,5-dihydroxy-2-(3-hydroxy-5-phenyl-pentyl)cyclopentyl]hept-5-enoic acid propyl ester Formula: C26H40O5 MolecularWeight: 432.5928

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCCC=CCC1C(CC(C1CCC(CCC2=CC=CC=C2)O)O)O

Isomeric SMILES

CCCOC(=O)CCC/C=C/CC1C(CC(C1CCC(CCC2=CC=CC=C2)O)O)O

InChI

InChI=1S/C26H40O5/c1-2-18-31-26(30)13-9-4-3-8-12-22-23(25(29)19-24(22)28)17-16-21(27)15-14-20-10-6-5-7-11-20/h3,5-8,10-11,21-25,27-29H,2,4,9,12-19H2,1H3/b8-3+