methyl 6-[(1R,2S,3R)-2-[(E)-5-cyclohexyl-3-oxidanyl-pent-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]sulfanylhexanoate

Systemtic Name: methyl 6-[(1R,2S,3R)-2-[(E)-5-cyclohexyl-3-oxidanyl-pent-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]sulfanylhexanoate Openeye Name: methyl 6-[(1R,2S,3R)-2-[(E)-5-cyclohexyl-3-hydroxy-pent-1-enyl]-3-hydroxy-5-oxo-cyclopentyl]sulfanylhexanoate CAS Name: 6-[[(1R,2S,3R)-2-[(E)-5-cyclohexyl-3-hydroxypent-1-enyl]-3-hydroxy-5-oxocyclopentyl]thio]hexanoic acid methyl ester IUPAC Name: methyl 6-[(1R,2S,3R)-2-[(E)-5-cyclohexyl-3-hydroxypent-1-enyl]-3-hydroxy-5-oxocyclopentyl]sulfanylhexanoate Traditional Name: 6-[[(1R,2S,3R)-2-[(E)-5-cyclohexyl-3-hydroxy-pent-1-enyl]-3-hydroxy-5-keto-cyclopentyl]thio]hexanoic acid methyl ester Formula: C23H38O5S MolecularWeight: 426.60982

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCSC1C(C(CC1=O)O)C=CC(CCC2CCCCC2)O

Isomeric SMILES

COC(=O)CCCCCS[C@@H]1[C@H]([C@@H](CC1=O)O)/C=C/C(CCC2CCCCC2)O

InChI

InChI=1S/C23H38O5S/c1-28-22(27)10-6-3-7-15-29-23-19(20(25)16-21(23)26)14-13-18(24)12-11-17-8-4-2-5-9-17/h13-14,17-20,23-25H,2-12,15-16H2,1H3/b14-13+/t18?,19-,20+,23+/m0/s1