propan-2-yl (E)-9-[3,5-bis(oxidanyl)-2-(3-oxidanyldecyl)cyclopentyl]non-7-enoate

Systemtic Name: propan-2-yl (E)-9-[3,5-bis(oxidanyl)-2-(3-oxidanyldecyl)cyclopentyl]non-7-enoate Openeye Name: isopropyl (E)-9-[3,5-dihydroxy-2-(3-hydroxydecyl)cyclopentyl]non-7-enoate CAS Name: (E)-9-[3,5-dihydroxy-2-(3-hydroxydecyl)cyclopentyl]-7-nonenoic acid propan-2-yl ester IUPAC Name: propan-2-yl (E)-9-[3,5-dihydroxy-2-(3-hydroxydecyl)cyclopentyl]non-7-enoate Traditional Name: (E)-9-[3,5-dihydroxy-2-(3-hydroxydecyl)cyclopentyl]non-7-enoic acid isopropyl ester Formula: C27H50O5 MolecularWeight: 454.6829

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CCC1C(CC(C1CC=CCCCCCC(=O)OC(C)C)O)O)O

Isomeric SMILES

CCCCCCCC(CCC1C(CC(C1C/C=C/CCCCCC(=O)OC(C)C)O)O)O

InChI

InChI=1S/C27H50O5/c1-4-5-6-9-12-15-22(28)18-19-24-23(25(29)20-26(24)30)16-13-10-7-8-11-14-17-27(31)32-21(2)3/h10,13,21-26,28-30H,4-9,11-12,14-20H2,1-3H3/b13-10+