2-[3-[2-[(E)-4-methyl-3-oxidanyl-oct-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]sulfanylpropylsulfanyl]ethanoic acid

Systemtic Name: 2-[3-[2-[(E)-4-methyl-3-oxidanyl-oct-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]sulfanylpropylsulfanyl]ethanoic acid Openeye Name: 2-[3-[3-hydroxy-2-[(E)-3-hydroxy-4-methyl-oct-1-enyl]-5-oxo-cyclopentyl]sulfanylpropylsulfanyl]acetic acid CAS Name: 2-[3-[[3-hydroxy-2-[(E)-3-hydroxy-4-methyloct-1-enyl]-5-oxocyclopentyl]thio]propylthio]acetic acid IUPAC Name: 2-[3-[3-hydroxy-2-[(E)-3-hydroxy-4-methyloct-1-enyl]-5-oxocyclopentyl]sulfanylpropylsulfanyl]acetic acid Traditional Name: 2-[3-[[3-hydroxy-2-[(E)-3-hydroxy-4-methyl-oct-1-enyl]-5-keto-cyclopentyl]thio]propylthio]acetic acid Formula: C19H32O5S2 MolecularWeight: 404.58438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C(C=CC1C(CC(=O)C1SCCCSCC(=O)O)O)O

Isomeric SMILES

CCCCC(C)C(/C=C/C1C(CC(=O)C1SCCCSCC(=O)O)O)O

InChI

InChI=1S/C19H32O5S2/c1-3-4-6-13(2)15(20)8-7-14-16(21)11-17(22)19(14)26-10-5-9-25-12-18(23)24/h7-8,13-16,19-21H,3-6,9-12H2,1-2H3,(H,23,24)/b8-7+