(E)-7-[3-ethylsulfanyl-2-oxidanylidene-1-[(E)-3-oxidanyloct-1-enyl]cyclopentyl]hept-5-enoic acid

Systemtic Name: (E)-7-[3-ethylsulfanyl-2-oxidanylidene-1-[(E)-3-oxidanyloct-1-enyl]cyclopentyl]hept-5-enoic acid Openeye Name: (E)-7-[3-ethylsulfanyl-1-[(E)-3-hydroxyoct-1-enyl]-2-oxo-cyclopentyl]hept-5-enoic acid CAS Name: (E)-7-[3-(ethylthio)-1-[(E)-3-hydroxyoct-1-enyl]-2-oxocyclopentyl]-5-heptenoic acid IUPAC Name: (E)-7-[3-ethylsulfanyl-1-[(E)-3-hydroxyoct-1-enyl]-2-oxocyclopentyl]hept-5-enoic acid Traditional Name: (E)-7-[3-(ethylthio)-1-[(E)-3-hydroxyoct-1-enyl]-2-keto-cyclopentyl]hept-5-enoic acid Formula: C22H36O4S MolecularWeight: 396.58384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1(CCC(C1=O)SCC)CC=CCCCC(=O)O)O

Isomeric SMILES

CCCCCC(/C=C/C1(CCC(C1=O)SCC)C/C=C/CCCC(=O)O)O

InChI

InChI=1S/C22H36O4S/c1-3-5-8-11-18(23)13-16-22(15-10-7-6-9-12-20(24)25)17-14-19(21(22)26)27-4-2/h7,10,13,16,18-19,23H,3-6,8-9,11-12,14-15,17H2,1-2H3,(H,24,25)/b10-7+,16-13+