6-[2-cyclopropyl-4-oxidanyl-5-[(E)-3-oxidanyloct-1-enyl]cyclopenten-1-yl]sulfanylhexanoic acid

Systemtic Name: 6-[2-cyclopropyl-4-oxidanyl-5-[(E)-3-oxidanyloct-1-enyl]cyclopenten-1-yl]sulfanylhexanoic acid Openeye Name: 6-[2-cyclopropyl-4-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]cyclopenten-1-yl]sulfanylhexanoic acid CAS Name: 6-[[2-cyclopropyl-4-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]-1-cyclopentenyl]thio]hexanoic acid IUPAC Name: 6-[2-cyclopropyl-4-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]cyclopenten-1-yl]sulfanylhexanoic acid Traditional Name: 6-[[2-cyclopropyl-4-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]cyclopenten-1-yl]thio]hexanoic acid Formula: C22H36O4S MolecularWeight: 396.58384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1C(CC(=C1SCCCCCC(=O)O)C2CC2)O)O

Isomeric SMILES

CCCCCC(/C=C/C1C(CC(=C1SCCCCCC(=O)O)C2CC2)O)O

InChI

InChI=1S/C22H36O4S/c1-2-3-5-8-17(23)12-13-18-20(24)15-19(16-10-11-16)22(18)27-14-7-4-6-9-21(25)26/h12-13,16-18,20,23-24H,2-11,14-15H2,1H3,(H,25,26)/b13-12+