[(2S,3S,4R,5R)-3,4,5-triacetyloxy-2-phenylsulfanyl-oxan-2-yl]methyl ethanoate

Systemtic Name: [(2S,3S,4R,5R)-3,4,5-triacetyloxy-2-phenylsulfanyl-oxan-2-yl]methyl ethanoate Openeye Name: [(2S,3S,4R,5R)-3,4,5-triacetoxy-2-phenylsulfanyl-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2S,3S,4R,5R)-3,4,5-triacetyloxy-2-(phenylthio)-2-oxanyl]methyl ester IUPAC Name: [(2S,3S,4R,5R)-3,4,5-triacetyloxy-2-phenylsulfanyloxan-2-yl]methyl acetate Traditional Name: acetic acid [(2S,3S,4R,5R)-3,4,5-triacetoxy-2-(phenylthio)tetrahydropyran-2-yl]methyl ester Formula: C20H24O9S MolecularWeight: 440.46416

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1(C(C(C(CO1)OC(=O)C)OC(=O)C)OC(=O)C)SC2=CC=CC=C2

Isomeric SMILES

CC(=O)OC[C@@]1([C@H]([C@@H]([C@@H](CO1)OC(=O)C)OC(=O)C)OC(=O)C)SC2=CC=CC=C2

InChI

InChI=1S/C20H24O9S/c1-12(21)25-11-20(30-16-8-6-5-7-9-16)19(29-15(4)24)18(28-14(3)23)17(10-26-20)27-13(2)22/h5-9,17-19H,10-11H2,1-4H3/t17-,18-,19+,20+/m1/s1