(E)-7-[3-(2-hydroxyethylsulfanyl)-2-[(E)-3-methyloct-1-enyl]-5-oxidanylidene-cyclopentyl]-2-oxidanyl-hept-5-enoate

Systemtic Name: (E)-7-[3-(2-hydroxyethylsulfanyl)-2-[(E)-3-methyloct-1-enyl]-5-oxidanylidene-cyclopentyl]-2-oxidanyl-hept-5-enoate Openeye Name: (E)-2-hydroxy-7-[3-(2-hydroxyethylsulfanyl)-2-[(E)-3-methyloct-1-enyl]-5-oxo-cyclopentyl]hept-5-enoate CAS Name: (E)-2-hydroxy-7-[3-(2-hydroxyethylthio)-2-[(E)-3-methyloct-1-enyl]-5-oxocyclopentyl]-5-heptenoate IUPAC Name: (E)-2-hydroxy-7-[3-(2-hydroxyethylsulfanyl)-2-[(E)-3-methyloct-1-enyl]-5-oxocyclopentyl]hept-5-enoate Traditional Name: (E)-2-hydroxy-7-[3-(2-hydroxyethylthio)-5-keto-2-[(E)-3-methyloct-1-enyl]cyclopentyl]hept-5-enoate Formula: C23H37O5S- MolecularWeight: 425.60188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C=CC1C(CC(=O)C1CC=CCCC(C(=O)[O-])O)SCCO

Isomeric SMILES

CCCCCC(C)/C=C/C1C(CC(=O)C1C/C=C/CCC(C(=O)[O-])O)SCCO

InChI

InChI=1S/C23H38O5S/c1-3-4-6-9-17(2)12-13-19-18(21(26)16-22(19)29-15-14-24)10-7-5-8-11-20(25)23(27)28/h5,7,12-13,17-20,22,24-25H,3-4,6,8-11,14-16H2,1-2H3,(H,27,28)/p-1/b7-5+,13-12+