Pyridine, 2-(beta-D-glucopyranosylthio)-, 1-oxide
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(1-oxidopyridin-1-ium-2-yl)sulfanyloxane-3,4,5-triol
Also Known As: 2-(beta-D-Glucopyranosylthio)pyridine 1-oxide|Pyridine, 2-(beta-D-glucopyranosylthio)-, 1-oxide|1-Oxo-1lambda~5~-pyridin-2-yl 1-thio-beta-D-glucopyranoside|(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(1-oxidopyridin-1-ium-2-yl)sulfanyloxane-3,4,5-triol
CAS: 2308-93-2
| Molecular Formula | C11H15NO6S |
|---|---|
| Molecular Weight | 289.062 g/mol |
| LogP | -1.788 |
| Topological Polar Surface Area | 117.09 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.062 |
| Monoisotopic Mass | 289.062 |
| Heavy Atoms | 19 |
| Complexity | 431.40137 |
Chemical Identifiers
| CAS Number | 2308-93-2 |
|---|---|
| SMILES | C1=CC=[N+](C(=C1)S[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)[O-] |
Product Overview
Pyridine, 2-(beta-D-glucopyranosylthio)-, 1-oxide (CAS 2308-93-2), with molecular formula C11H15NO6S and molecular weight 289.062 g/mol. IUPAC: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(1-oxidopyridin-1-ium-2-yl)sulfanyloxane-3,4,5-triol.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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