2-(N-3'-Sialyllactityl)aminopyridine
(2S,4S,5R,6R)-5-acetamido-2-[(2R,3S,4S,5R,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3R,4R,5S)-1,2,4,5-tetrahydroxy-6-(pyridin-2-ylamino)hexan-3-yl]oxyoxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
Also Known As: 3-SL-AP|2-(N-3'-Sialyllactityl)aminopyridine|(2S,4S,5R,6R)-5-acetamido-2-[(2R,3S,4S,5R,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3R,4R,5S)-1,2,4,5-tetrahydroxy-6-(pyridin-2-ylamino)hexan-3-yl]oxyoxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid|D-Glucitol, O-(N-acetyl-alpha-neuraminosyl)-(2-3)-O-beta-D-galactopyranosyl-(1-4)-1-deoxy-1-(2-pyridinylamino)-|5-Acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-1-deoxy-1-[(pyridin-2-yl)amino]-D-glucitol
| Molecular Formula | C28H45N3O18 |
|---|---|
| Molecular Weight | 711.26984 g/mol |
| LogP | -5.5 |
| Topological Polar Surface Area | 351.0 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 17 |
| Exact Mass | 711.26984 |
| Monoisotopic Mass | 711.26984 |
| Heavy Atoms | 49 |
| Complexity | 1050.0 |
Chemical Identifiers
| CAS Number | 83073-74-9 |
|---|---|
| SMILES | CC(=O)N[C@@H]1[C@H](C[C@@](O[C@H]1[C@@H]([C@@H](CO)O)O)(C(=O)O)O[C@H]2[C@H]([C@H](O[C@H]([C@@H]2O)O[C@H]([C@@H](CO)O)[C@@H]([C@H](CNC3=CC=CC=N3)O)O)CO)O)O |
| InChIKey | NDMJFTOMBNOPNX-MHEPVMCTSA-N |
Product Overview
2-(N-3'-Sialyllactityl)aminopyridine (CAS 83073-74-9), with molecular formula C28H45N3O18 and molecular weight 711.26984 g/mol. IUPAC: (2S,4S,5R,6R)-5-acetamido-2-[(2R,3S,4S,5R,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3R,4R,5S)-1,2,4,5-tetrahydroxy-6-(pyridin-2-ylamino)hexan-3-yl]oxyoxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid.