[(2S,3R,4R,5R,6S)-5-acetyloxy-2-methyl-6-(4-methylphenyl)sulfanyl-4-oxidanyl-oxan-3-yl] ethanoate

Systemtic Name: [(2S,3R,4R,5R,6S)-5-acetyloxy-2-methyl-6-(4-methylphenyl)sulfanyl-4-oxidanyl-oxan-3-yl] ethanoate Openeye Name: [(2S,3R,4R,5R,6S)-5-acetoxy-4-hydroxy-2-methyl-6-(p-tolylsulfanyl)tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(2S,3R,4R,5R,6S)-5-acetyloxy-4-hydroxy-2-methyl-6-[(4-methylphenyl)thio]-3-oxanyl] ester IUPAC Name: [(2S,3R,4R,5R,6S)-5-acetyloxy-4-hydroxy-2-methyl-6-(4-methylphenyl)sulfanyloxan-3-yl] acetate Traditional Name: acetic acid [(2S,3R,4R,5R,6S)-5-acetoxy-4-hydroxy-2-methyl-6-(p-tolylthio)tetrahydropyran-3-yl] ester Formula: C17H22O6S MolecularWeight: 354.41798

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)SC2=CC=C(C=C2)C)OC(=O)C)O)OC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C17H22O6S/c1-9-5-7-13(8-6-9)24-17-16(23-12(4)19)14(20)15(10(2)21-17)22-11(3)18/h5-8,10,14-17,20H,1-4H3/t10-,14+,15-,16+,17-/m0/s1