(E)-7-[3-oxidanyl-2-[(E)-3-oxidanyloct-1-enyl]-5-sulfanyl-cyclopentyl]hept-4-enoic acid

Systemtic Name: (E)-7-[3-oxidanyl-2-[(E)-3-oxidanyloct-1-enyl]-5-sulfanyl-cyclopentyl]hept-4-enoic acid Openeye Name: (E)-7-[3-hydroxy-2-[(E)-3-hydroxyoct-1-enyl]-5-sulfanyl-cyclopentyl]hept-4-enoic acid CAS Name: (E)-7-[3-hydroxy-2-[(E)-3-hydroxyoct-1-enyl]-5-mercaptocyclopentyl]-4-heptenoic acid IUPAC Name: (E)-7-[3-hydroxy-2-[(E)-3-hydroxyoct-1-enyl]-5-sulfanylcyclopentyl]hept-4-enoic acid Traditional Name: (E)-7-[3-hydroxy-2-[(E)-3-hydroxyoct-1-enyl]-5-mercapto-cyclopentyl]hept-4-enoic acid Formula: C20H34O4S MolecularWeight: 370.54656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1C(CC(C1CCC=CCCC(=O)O)S)O)O

Isomeric SMILES

CCCCCC(/C=C/C1C(CC(C1CC/C=C/CCC(=O)O)S)O)O

InChI

InChI=1S/C20H34O4S/c1-2-3-6-9-15(21)12-13-16-17(19(25)14-18(16)22)10-7-4-5-8-11-20(23)24/h4-5,12-13,15-19,21-22,25H,2-3,6-11,14H2,1H3,(H,23,24)/b5-4+,13-12+