7-[3-methylsulfanyl-2-oxidanylidene-5-[(E)-3-oxidanyloct-1-enyl]cyclopent-3-en-1-yl]-7-oxidanyl-heptanoic acid

Systemtic Name: 7-[3-methylsulfanyl-2-oxidanylidene-5-[(E)-3-oxidanyloct-1-enyl]cyclopent-3-en-1-yl]-7-oxidanyl-heptanoic acid Openeye Name: 7-hydroxy-7-[5-[(E)-3-hydroxyoct-1-enyl]-3-methylsulfanyl-2-oxo-cyclopent-3-en-1-yl]heptanoic acid CAS Name: 7-hydroxy-7-[5-[(E)-3-hydroxyoct-1-enyl]-3-(methylthio)-2-oxo-1-cyclopent-3-enyl]heptanoic acid IUPAC Name: 7-hydroxy-7-[5-[(E)-3-hydroxyoct-1-enyl]-3-methylsulfanyl-2-oxocyclopent-3-en-1-yl]heptanoic acid Traditional Name: 7-hydroxy-7-[5-[(E)-3-hydroxyoct-1-enyl]-2-keto-3-(methylthio)cyclopent-3-en-1-yl]enanthic acid Formula: C21H34O5S MolecularWeight: 398.55666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1C=C(C(=O)C1C(CCCCCC(=O)O)O)SC)O

Isomeric SMILES

CCCCCC(/C=C/C1C=C(C(=O)C1C(CCCCCC(=O)O)O)SC)O

InChI

InChI=1S/C21H34O5S/c1-3-4-6-9-16(22)13-12-15-14-18(27-2)21(26)20(15)17(23)10-7-5-8-11-19(24)25/h12-17,20,22-23H,3-11H2,1-2H3,(H,24,25)/b13-12+