Account N-((2R,3R,4R,5R,6R)-2-(((2R,3R,4R,5R)-2-Acetamido-4,5,6-trihydroxy-1-oxohexan-3-yl)oxy)-5-hydroxy-6-(hydroxymethyl)-4-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl)acetamide
- Catalog No. :
- ACBLHY555
- CAS No. :
- 886750-14-7
- Molecular Formula :
- C22H38N2O16
- Molecular Weight :
- 586.54
IUPAC Name:N-((2R,3R,4R,5R,6R)-2-(((2R,3R,4R,5R)-2-acetamido-4,5,6-trihydroxy-1-oxohexan-3-yl)oxy)-5-hydroxy-6-(hydroxymethyl)-4-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl)acetamide
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Product Information
| Product Name | N-((2R,3R,4R,5R,6R)-2-(((2R,3R,4R,5R)-2-Acetamido-4,5,6-trihydroxy-1-oxohexan-3-yl)oxy)-5-hydroxy-6-(hydroxymethyl)-4-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl)acetamide |
|---|---|
| IUPAC Name | N-((2R,3R,4R,5R,6R)-2-(((2R,3R,4R,5R)-2-acetamido-4,5,6-trihydroxy-1-oxohexan-3-yl)oxy)-5-hydroxy-6-(hydroxymethyl)-4-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl)acetamide |
| Molecular Formula | C22H38N2O16 |
| Molecular Weight | 586.54 |
| SMILES | CC(N[C@@H]1[C@H]([C@H]([C@H](O[C@H]1O[C@@H]([C@H](O)[C@H](O)CO)[C@H](C=O)NC(C)=O)CO)O)O[C@H]2O[C@@H]([C@@H]([C@@H]([C@H]2O)O)O)CO)=O |
| InChI Key | KPMQNVVWPPWWHK-QDEHULMKSA-N |
| Synonym | O-2-Acetamido-2-deoxy-alpha-D-galactosyl-(1 - 3)-O-beta-D-galactosyl-(1 - 3)-2-acetamido-2-deoxy-D-glucose;D-Glucose, O-2-acetamido-2-deoxy-α-D-galactosyl-(1 → 3)-O-β-D-galactosyl-(1 → 3)-2-acetamido-2-deoxy- (7CI) |
| CAS No. | 886750-14-7 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Synthetic Route by SureRoute
2. ACBLHY555 Molecular Building Block Synthetic Route
N-((2R,3R,4R,5R)-3-(((2R,3R,4S,5S,6R)-3,5-Dihydroxy-6-(hydroxymethyl)-4-(((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-4,5,6-trihydroxy-1-oxohexan-2-yl)acetamide
2-(Acetylamino)-2-deoxy-3-O-beta-D-galactopyranosyl-D-galactose
Lacto-N-biose I