Account O-((2S,3S,4R,5R,6S)-3-acetamido-4-(((2R,3S,4R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-5-hydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-L-threonine
- Catalog No. :
- ACJFDE047
- CAS No. :
- 286959-52-2
- Molecular Formula :
- C20H35N3O13
- Molecular Weight :
- 525.51
IUPAC Name:O-((2S,3S,4R,5R,6S)-3-acetamido-4-(((2R,3S,4R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-5-hydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-L-threonine
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Product Information
| Product Name | O-((2S,3S,4R,5R,6S)-3-acetamido-4-(((2R,3S,4R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-5-hydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-L-threonine |
|---|---|
| IUPAC Name | O-((2S,3S,4R,5R,6S)-3-acetamido-4-(((2R,3S,4R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-5-hydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-L-threonine |
| Molecular Formula | C20H35N3O13 |
| Molecular Weight | 525.51 |
| SMILES | CC(=O)N[C@@H]1[C@H](O[C@H]2[C@@H](O)[C@H](CO)O[C@H](O[C@H](C)[C@H](N)C(=O)O)[C@H]2NC(C)=O)O[C@@H](CO)[C@@H](O)[C@@H]1O |
| InChI Key | BMSPZGKRTLZXAV-RGVQASSVSA-N |
| Synonym | (2S,3R)-3-{[(2S,3S,4R,5R,6S)-3-Acetamido-4-{[(2R,3S,4R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-aminobutanoic acid (non-preferred name) | GlcNAc beta(1-3)GalNAc-alpha-Thr | MFCD15072165 | |
| CAS No. | 286959-52-2 |
| PubChem CID | 53384351 |
Synthetic Route by SureRoute
2. ACJFDE047 Molecular Building Block Synthetic Route
O-((2S,3S,4R,5R,6S)-3-acetamido-4-(((2R,3S,4R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-6-((((2R,3S,4R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)-5-hydroxytetrahydro-2H-pyran-2-yl)-L-threonine
O-((2S,3R,4R,5R,6R)-3-Acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-L-threonine
T Epitope, Threonyl