N-acetyl-7-O-acetylneuraminic acid
(2S,4S,5R,6R)-5-acetamido-6-(1-acetyloxy-2,3-dihydroxypropyl)-2,4-dihydroxyoxane-2-carboxylic acid
Also Known As: GlyTouCan:G79608HE|N-acetyl-7-O-acetylneuraminic acid|G79608HE|Neuraminic acid,N-acetyl-, 7-acetate (7CI,9CI)|7-O-Acetyl-3,5-dideoxy-5-[(1-hydroxyethylidene)amino]non-2-ulopyranosonic acid|(2S,4S,5R,6R)-5-acetamido-6-(1-acetyloxy-2,3-dihydroxypropyl)-2,4-dihydroxyoxane-2-carboxylic acid|(2S,4S,5R,6R)-6-((1R,2R)-1-(acetyloxy)-2,3-dihydroxypropyl)-5-acetamido-2,4-dihydroxyoxane-2-carboxylic acid
| Molecular Formula | C13H21NO10 |
|---|---|
| Molecular Weight | 351.11655 g/mol |
| LogP | -3.4 |
| Topological Polar Surface Area | 183.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 351.11655 |
| Monoisotopic Mass | 351.11655 |
| Heavy Atoms | 24 |
| Complexity | 497.0 |
Chemical Identifiers
| CAS Number | 18529-63-0 |
|---|---|
| SMILES | CC(=O)N[C@@H]1[C@H](C[C@](O[C@H]1C(C(CO)O)OC(=O)C)(C(=O)O)O)O |
| InChIKey | DUOKWMWKFGDUDQ-ZXQYLZRESA-N |
Product Overview
N-acetyl-7-O-acetylneuraminic acid (CAS 18529-63-0), with molecular formula C13H21NO10 and molecular weight 351.11655 g/mol. IUPAC: (2S,4S,5R,6R)-5-acetamido-6-(1-acetyloxy-2,3-dihydroxypropyl)-2,4-dihydroxyoxane-2-carboxylic acid.
N-acetyl-7-O-acetylneuraminic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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