[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-[(5-oxidanyl-4-oxidanylidene-pyran-2-yl)methylsulfanyl]oxan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-[(5-oxidanyl-4-oxidanylidene-pyran-2-yl)methylsulfanyl]oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3R,4S,5R,6S)-3,4,5-triacetoxy-6-[(5-hydroxy-4-oxo-pyran-2-yl)methylsulfanyl]tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-[(5-hydroxy-4-oxo-2-pyranyl)methylthio]-2-oxanyl]methyl ester IUPAC Name: [(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-[(5-hydroxy-4-oxopyran-2-yl)methylsulfanyl]oxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3R,4S,5R,6S)-3,4,5-triacetoxy-6-[(5-hydroxy-4-keto-pyran-2-yl)methylthio]tetrahydropyran-2-yl]methyl ester Formula: C20H24O12S MolecularWeight: 488.46236

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)SCC2=CC(=O)C(=CO2)O)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)SCC2=CC(=O)C(=CO2)O)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C20H24O12S/c1-9(21)27-7-16-17(29-10(2)22)18(30-11(3)23)19(31-12(4)24)20(32-16)33-8-13-5-14(25)15(26)6-28-13/h5-6,16-20,26H,7-8H2,1-4H3/t16-,17-,18+,19-,20+/m1/s1