[(2R,3S,4S,5R,6S)-3,4-diacetyloxy-6-methylsulfanyl-5-phenylmethoxy-oxan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3S,4S,5R,6S)-3,4-diacetyloxy-6-methylsulfanyl-5-phenylmethoxy-oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3S,4S,5R,6S)-3,4-diacetoxy-5-benzyloxy-6-methylsulfanyl-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3S,4S,5R,6S)-3,4-diacetyloxy-6-(methylthio)-5-phenylmethoxy-2-oxanyl]methyl ester IUPAC Name: [(2R,3S,4S,5R,6S)-3,4-diacetyloxy-6-methylsulfanyl-5-phenylmethoxyoxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3S,4S,5R,6S)-3,4-diacetoxy-5-benzoxy-6-(methylthio)tetrahydropyran-2-yl]methyl ester Formula: C20H26O8S MolecularWeight: 426.48064

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)SC)OCC2=CC=CC=C2)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)SC)OCC2=CC=CC=C2)OC(=O)C)OC(=O)C

InChI

InChI=1S/C20H26O8S/c1-12(21)24-11-16-17(26-13(2)22)18(27-14(3)23)19(20(28-16)29-4)25-10-15-8-6-5-7-9-15/h5-9,16-20H,10-11H2,1-4H3/t16-,17+,18+,19-,20+/m1/s1