galactosyl-beta-D-(1-4)-N-acetyllactosamine
N-[4-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1,3,5,6-tetrahydroxyhexan-2-yl]acetamide
Also Known As: Sid 769514|Galactosyl-beta-D-(1-4)-N-acetyllactosamine|N-[4-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1,3,5,6-tetrahydroxyhexan-2-yl]acetamide|N0001-003499|4-O-beta-D-Galactopyranosyl-beta-D-(1-4)-galactopyranosyl-N-acetyl-D-glucosamine|Hexopyranosyl-(1->4)hexopyranosyl-(1->4)-2-deoxy-2-[(1-hydroxyethylidene)amino]hexitol|(3R,4R,5S,6R)-5-(((2S,3R,4R,5R,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-2,3,4-triol|D-Glucitol, O-beta-D-galactopyranosyl-(1-4)-O-beta-D-galactopyranosyl-(1-4)-2-(acetylamino)-2-deoxy-
| Molecular Formula | C20H37NO16 |
|---|---|
| Molecular Weight | 547.21124 g/mol |
| LogP | -7.4 |
| Topological Polar Surface Area | 289.0 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 12 |
| Exact Mass | 547.21124 |
| Monoisotopic Mass | 547.21124 |
| Heavy Atoms | 37 |
| Complexity | 703.0 |
Chemical Identifiers
| CAS Number | 38237-96-6 |
|---|---|
| SMILES | CC(=O)NC(CO)C(C(C(CO)O)OC1C(C(C(C(O1)CO)OC2C(C(C(C(O2)CO)O)O)O)O)O)O |
| InChIKey | FBKYZIAXGIOXIY-UHFFFAOYSA-N |
Product Overview
galactosyl-beta-D-(1-4)-N-acetyllactosamine (CAS 38237-96-6), with molecular formula C20H37NO16 and molecular weight 547.21124 g/mol. IUPAC: N-[4-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1,3,5,6-tetrahydroxyhexan-2-yl]acetamide.