6-[2-methoxycarbonyl-5-[(E)-5-methyl-3-oxidanyl-non-1-enyl]-4-oxidanyl-cyclopenten-1-yl]sulfanylhexanoate

Systemtic Name: 6-[2-methoxycarbonyl-5-[(E)-5-methyl-3-oxidanyl-non-1-enyl]-4-oxidanyl-cyclopenten-1-yl]sulfanylhexanoate Openeye Name: 6-[4-hydroxy-5-[(E)-3-hydroxy-5-methyl-non-1-enyl]-2-methoxycarbonyl-cyclopenten-1-yl]sulfanylhexanoate CAS Name: 6-[[4-hydroxy-5-[(E)-3-hydroxy-5-methylnon-1-enyl]-2-methoxycarbonyl-1-cyclopentenyl]thio]hexanoate IUPAC Name: 6-[4-hydroxy-5-[(E)-3-hydroxy-5-methylnon-1-enyl]-2-methoxycarbonylcyclopenten-1-yl]sulfanylhexanoate Traditional Name: 6-[[2-carbomethoxy-4-hydroxy-5-[(E)-3-hydroxy-5-methyl-non-1-enyl]cyclopenten-1-yl]thio]hexanoate Formula: C23H37O6S- MolecularWeight: 441.60128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)CC(C=CC1C(CC(=C1SCCCCCC(=O)[O-])C(=O)OC)O)O

Isomeric SMILES

CCCCC(C)CC(/C=C/C1C(CC(=C1SCCCCCC(=O)[O-])C(=O)OC)O)O

InChI

InChI=1S/C23H38O6S/c1-4-5-9-16(2)14-17(24)11-12-18-20(25)15-19(23(28)29-3)22(18)30-13-8-6-7-10-21(26)27/h11-12,16-18,20,24-25H,4-10,13-15H2,1-3H3,(H,26,27)/p-1/b12-11+