5'-O-beta-D-Glucosylpyridoxine
(2R,3R,4S,5S,6R)-2-[[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: -beta-D-Glucoside|5'-O-beta-D-Glucosylpyridoxine|Pyridoxine Impurity 26|5'-Pyridoxine glucoside|pyridoxine-beta-glucoside|Pyridoxine beta-glucoside|beta-D-Glucopyranoside pyridoxol|#NAME?|Pyridoxine 5 -glucoside|Pyridoxine-5'-beta-D-glucoside|5'-O-(Glucopyranosyl)pyridoxine|Pyridoxine 5'-beta-D-Glucoside|5'-O-(beta-D-Glucopyranosyl)pyridoxine|5 -O-beta-D-Glucosylpyridoxine|7-O-(beta-D-Glucopyranosyl)pyridoxine|5 -Deoxypyridoxine-5 -yl beta-D-glucopyranoside|(2R,3R,4S,5S,6R)-2-[[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol|[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methyl beta-D-glucopyranoside|2-Methyl-4-(hydroxymethyl)-5-(beta-D-glucopyranosyloxymethyl)pyridine-3-ol|(2-Methyl-3-hydroxy-4-(hydroxymethyl)-5-pyridyl)methyl beta-D-glucopyranoside|[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]methyl beta-D-Glucopyranoside|2-Methyl-4-(hydroxymethyl)-5-(beta-D-glucopyranosyloxymethyl)-pyridine-3-ol|(2R,3R,4S,5S,6R)-2-{[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol|[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]methyl ss-D-glucopyranoside; 5'-O-(ss-D-Glucopyranosyl)pyridoxine; Pyridoxine 5'-ss-D-glucoside
| Molecular Formula | C14H21NO8 |
|---|---|
| Molecular Weight | 331.1267 g/mol |
| LogP | -1.9 |
| Topological Polar Surface Area | 153.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 331.1267 |
| Monoisotopic Mass | 331.1267 |
| Heavy Atoms | 23 |
| Complexity | 373.0 |
Chemical Identifiers
| CAS Number | 26545-80-2 |
|---|---|
| SMILES | CC1=NC=C(C(=C1O)CO)CO[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O |
| InChIKey | MDLTWTOQCHCLSZ-RGCYKPLRSA-N |
Product Overview
5'-O-beta-D-Glucosylpyridoxine (CAS 26545-80-2), with molecular formula C14H21NO8 and molecular weight 331.1267 g/mol. IUPAC: (2R,3R,4S,5S,6R)-2-[[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol.