Account (2R,4S,5R,6R)-5-acetamido-2-(((2R,3R,4R,5R,6S)-5-acetamido-3-hydroxy-6-(4-nitrophenoxy)-4-(((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)methoxy)-4-hydroxy-6-((1R,2R)-1,2,3-trihydroxypropyl)tetrahydro-2H-pyran-2-carboxylic acid
- Catalog No. :
- ACYEKD394
- CAS No. :
- 1984814-42-7
- Molecular Formula :
- C31H45N3O21
- Molecular Weight :
- 795.70
IUPAC Name:(2R,4S,5R,6R)-5-acetamido-2-(((2R,3R,4R,5R,6S)-5-acetamido-3-hydroxy-6-(4-nitrophenoxy)-4-(((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)methoxy)-4-hydroxy-6-((1R,2R)-1,2,3-trihydroxypropyl)tetrahydro-2H-pyran-2-carboxylic acid
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Product Information
| Product Name | (2R,4S,5R,6R)-5-acetamido-2-(((2R,3R,4R,5R,6S)-5-acetamido-3-hydroxy-6-(4-nitrophenoxy)-4-(((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)methoxy)-4-hydroxy-6-((1R,2R)-1,2,3-trihydroxypropyl)tetrahydro-2H-pyran-2-carboxylic acid |
|---|---|
| IUPAC Name | (2R,4S,5R,6R)-5-acetamido-2-(((2R,3R,4R,5R,6S)-5-acetamido-3-hydroxy-6-(4-nitrophenoxy)-4-(((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)methoxy)-4-hydroxy-6-((1R,2R)-1,2,3-trihydroxypropyl)tetrahydro-2H-pyran-2-carboxylic acid |
| Molecular Formula | C31H45N3O21 |
| Molecular Weight | 795.70 |
| SMILES | CC(=O)N[C@H]1[C@H](OC2=CC=C([N+](=O)[O-])C=C2)O[C@H](CO[C@]2(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O2)[C@H](O)[C@@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O |
| InChI Key | OQZSJFGKSKBLDR-CHTWOQIVSA-N |
| Synonym | β-D-Galactopyranoside, 4-nitrophenyl O-(N-acetyl-α-neuraminosyl)-(2→6)-O-[β-D-galactopyranosyl-(1→3)]-2-(acetylamino)-2-deoxy- |
| CAS No. | 1984814-42-7 |
| PubChem CID | 101895010 |
Synthetic Route by SureRoute
2. ACYEKD394 Molecular Building Block Synthetic Route
(2R,4S,5R,6R)-5-acetamido-2-(((2R,3S,4R,5R,6S)-5-acetamido-3-hydroxy-6-(4-nitrophenoxy)-4-(((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)methoxy)-4-hydroxy-6-((1R,2R)-1,2,3-trihydroxypropyl)tetrahydro-2H-pyran-2-carboxylic acid
(2R,4R,5R)-5-acetamido-2-(((3R,5S,6R)-5-acetamido-3-hydroxy-6-(4-nitrophenoxy)-4-(((2R,3S,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)methoxy)-4-hydroxy-6-((1R,2R)-1,2,3-trihydroxypropyl)tetrahydro-2H-pyran-2-carboxylic acid
(2R,4S,5R,6R)-5-acetamido-2-(((2R,3R,4R,5R,6R)-5-acetamido-4-(((2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3-hydroxy-6-(4-nitrophenoxy)tetrahydro-2H-pyran-2-yl)methoxy)-4-hydroxy-6-((1R,2R)-1,2,3-trihydroxypropyl)tetrahydro-2H-pyran-2-carboxylic acid