4-O-mannopyranosyl-2-acetamido-2-deoxyglucose
N-[(2R,3R,4S,5R)-3,5,6-trihydroxy-1-oxo-4-[(3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexan-2-yl]acetamide
Also Known As: 4-Mpadg|Manb(1-4)glcnac|PNALA|Man-b-1,4-GlcNAc|Mannosyl-(1-4)-acetylglucosamine|Mannosyl-(1-4)-N-acetylglucosamine|Mannosyl-beta(1-4)-N-acetylglucosamine|4-O-Mannopyranosyl-2-acetamido-2-deoxyglucose|2-acetamido-2-deoxy-4-o-d-mannopyranosyl-d-glucose|4-O-beta-D-Mannopyranosyl-2-acetamido-2-deoxy-D-glucose|D-Glucose, 2-(acetylamino)-2-deoxy-4-O-beta-D-mannopyranosyl-|2-(Acetylamino)-2-deoxy-4-O--D-mannopyranosyl-D-glucose|2-Acetamido-2-deoxy-4-O-(beta-D-mannopyranosyl)-D-glucose|2-Deoxy-4-O-hexopyranosyl-2-[(1-hydroxyethylidene)amino]hexose|N-[(2R,3R,4S,5R)-3,5,6-trihydroxy-1-oxo-4-[(3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexan-2-yl]acetamide|2-ACETAMIDO-2-DEOXY-4-O-(B-D-MANNOPYRANOSYL)-D-GLUCOSE|2-Deoxy-2-[(1-hydroxyethylidene)amino]-4-O-D-mannopyranosyl-D-glucose|2-Acetamido-2-deoxy-4-O-(o inverted exclamation mark?-D-mannopyranosyl)-D-glucose
| Molecular Formula | C14H25NO11 |
|---|---|
| Molecular Weight | 383.14276 g/mol |
| LogP | -5.0 |
| Topological Polar Surface Area | 206.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 383.14276 |
| Monoisotopic Mass | 383.14276 |
| Heavy Atoms | 26 |
| Complexity | 464.0 |
Chemical Identifiers
| CAS Number | 6340-64-3 |
|---|---|
| SMILES | CC(=O)N[C@@H](C=O)[C@H]([C@@H]([C@@H](CO)O)OC1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O |
| InChIKey | HESSGHHCXGBPAJ-BBHPJHERSA-N |
Product Overview
4-O-mannopyranosyl-2-acetamido-2-deoxyglucose (CAS 6340-64-3), with molecular formula C14H25NO11 and molecular weight 383.14276 g/mol. IUPAC: N-[(2R,3R,4S,5R)-3,5,6-trihydroxy-1-oxo-4-[(3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexan-2-yl]acetamide.