1-Thio-beta-D-glucose pentaacetate

[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-acetylsulfanyloxan-2-yl]methyl acetate

Also Known As: 1-Thio-beta-D-glucose pentaacetate|EINECS 237-128-3|1-thio-|A-D-glucose pentaacetate|1-Thio-beta-D-glucopyranose pentaacetate|(2R,3R,4S,5R,6S)-2-(Acetoxymethyl)-6-(acetylthio)tetrahydro-2H-pyran-3,4,5-triyl triacetate|1,2,3,4,6-Penta-O-acetyl-b-D-thioglucopyranose|.beta.-D-Glucopyranose, 1-thio-, pentaacetate|[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-acetylsulfanyloxan-2-yl]methyl acetate|2,3,4,6-tetra-O-acetyl-1-S-acetyl-1-thiohexopyranose|1,4-dimethyl-2,5,7-trithia-bicyclo[2.2.1]heptane|1-Thio-beta-D-glucopyranose 1,2,3,4,6-pentaacetate|1-(Acetylthio)-1-deoxy-beta-D-glucopyranose tetraacetate|2,3,4,6-tetra-o-acetyl-1-s-acetyl-1-thio-|A-d-glucopyranose|Acetyl 2-O,3-O,4-O,6-O-tetraacetyl-1-thio-beta-D-glucopyranoside|1-(Acetylthio)-2-O,3-O,4-O,6-O-tetraacetyl-1-deoxy-beta-D-glucopyranose|1-S-Acetyl-2-O,3-O,4-O,6-O-tetraacetyl-1-thio-beta-D-glucopyranose|[(2R,3R,4S,5R,6S)-3,4,5-triacetoxy-6-acetylsulfanyl-tetrahydropyran-2-yl]methyl acetate|[(2R,3R,4S,5R,6S)-3,4,5-tris(acetyloxy)-6-(acetylsulfanyl)oxan-2-yl]methyl acetate|Thioacetic acid S-(2-O,3-O,4-O,6-O-tetraacetyl-beta-D-glucopyranosyl) ester

Molecular Formula	C16H22O10S
Molecular Weight	406.09335 g/mol
LogP	0.35
Topological Polar Surface Area	131.5 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	11
Rotatable Bonds	6
Exact Mass	406.09335
Heavy Atoms	27
Complexity	604.0

Chemical Identifiers

CAS Number	13639-50-4
SMILES	CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)SC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C