methyl (2R)-2-[(2S,3S,4S)-4-methyl-2-octyl-5-oxidanylidene-4-phenylsulfanyl-oxolan-3-yl]-2-oxidanyl-ethanoate

Systemtic Name: methyl (2R)-2-[(2S,3S,4S)-4-methyl-2-octyl-5-oxidanylidene-4-phenylsulfanyl-oxolan-3-yl]-2-oxidanyl-ethanoate Openeye Name: methyl (2R)-2-hydroxy-2-[(2S,3S,4S)-4-methyl-2-octyl-5-oxo-4-phenylsulfanyl-tetrahydrofuran-3-yl]acetate CAS Name: (2R)-2-hydroxy-2-[(2S,3S,4S)-4-methyl-2-octyl-5-oxo-4-(phenylthio)-3-oxolanyl]acetic acid methyl ester IUPAC Name: methyl (2R)-2-hydroxy-2-[(2S,3S,4S)-4-methyl-2-octyl-5-oxo-4-phenylsulfanyloxolan-3-yl]acetate Traditional Name: (2R)-2-hydroxy-2-[(2S,3S,4S)-5-keto-4-methyl-2-octyl-4-(phenylthio)tetrahydrofuran-3-yl]acetic acid methyl ester Formula: C22H32O5S MolecularWeight: 408.55148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1C(C(C(=O)O1)(C)SC2=CC=CC=C2)C(C(=O)OC)O

Isomeric SMILES

CCCCCCCC[C@H]1[C@@H]([C@](C(=O)O1)(C)SC2=CC=CC=C2)[C@H](C(=O)OC)O

InChI

InChI=1S/C22H32O5S/c1-4-5-6-7-8-12-15-17-18(19(23)20(24)26-3)22(2,21(25)27-17)28-16-13-10-9-11-14-16/h9-11,13-14,17-19,23H,4-8,12,15H2,1-3H3/t17-,18+,19+,22-/m0/s1