[(2R,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-aminocarbonyl-6-(methylsulfanylmethoxy)oxan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-aminocarbonyl-6-(methylsulfanylmethoxy)oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3S,4S,5R,6R)-3,4,5-triacetoxy-6-carbamoyl-6-(methylsulfanylmethoxy)tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-carbamoyl-6-[(methylthio)methoxy]-2-oxanyl]methyl ester IUPAC Name: [(2R,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-carbamoyl-6-(methylsulfanylmethoxy)oxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3S,4S,5R,6R)-3,4,5-triacetoxy-6-carbamoyl-6-[(methylthio)methoxy]tetrahydropyran-2-yl]methyl ester Formula: C17H25NO11S MolecularWeight: 451.4455

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)(C(=O)N)OCSC)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@@H]([C@@H]([C@H]([C@](O1)(C(=O)N)OCSC)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C17H25NO11S/c1-8(19)24-6-12-13(26-9(2)20)14(27-10(3)21)15(28-11(4)22)17(29-12,16(18)23)25-7-30-5/h12-15H,6-7H2,1-5H3,(H2,18,23)/t12-,13+,14+,15-,17+/m1/s1