Account sodium (2R,3S,4R,5R)-2-((((((((2R,3S,4R,5R)-5-(3-acetylpyridin-1-ium-1-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)oxidophosphoryl)oxy)(hydroxy)phosphoryl)oxy)methyl)-5-(6-amino-9H-purin-9-yl)-4-hydroxytetrahydrofuran-3-yl phosphate
- Catalog No. :
- ACNETX590
- CAS No. :
- 102029-67-4
- Molecular Formula :
- C22H27N6Na2O17P3
- Molecular Weight :
- 786.39
IUPAC Name:sodium (2R,3S,4R,5R)-2-((((((((2R,3S,4R,5R)-5-(3-acetylpyridin-1-ium-1-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)oxidophosphoryl)oxy)(hydroxy)phosphoryl)oxy)methyl)-5-(6-amino-9H-purin-9-yl)-4-hydroxytetrahydrofuran-3-yl phosphate
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Product Information
| Product Name | sodium (2R,3S,4R,5R)-2-((((((((2R,3S,4R,5R)-5-(3-acetylpyridin-1-ium-1-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)oxidophosphoryl)oxy)(hydroxy)phosphoryl)oxy)methyl)-5-(6-amino-9H-purin-9-yl)-4-hydroxytetrahydrofuran-3-yl phosphate |
|---|---|
| IUPAC Name | sodium (2R,3S,4R,5R)-2-((((((((2R,3S,4R,5R)-5-(3-acetylpyridin-1-ium-1-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)oxidophosphoryl)oxy)(hydroxy)phosphoryl)oxy)methyl)-5-(6-amino-9H-purin-9-yl)-4-hydroxytetrahydrofuran-3-yl phosphate |
| Molecular Formula | C22H27N6Na2O17P3 |
| Molecular Weight | 786.39 |
| SMILES | CC(=O)C1=C[N+]([C@@H]2O[C@H](COP(=O)([O-])OP(=O)(O)OC[C@H]3O[C@@H](N4C=NC5=C(N)N=CN=C54)[C@H](O)[C@@H]3OP(=O)([O-])[O-])[C@@H](O)[C@H]2O)=CC=C1.[Na+].[Na+] |
| InChI Key | UBBVKPMLSMCNSN-MNXWHKAMSA-L |
| CAS No. | 102029-67-4 |
Synthetic Route by SureRoute
2. ACNETX590 Molecular Building Block Synthetic Route
3-Acetyl-1-((2R,3R,4S,5R)-5-((((((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)oxidophosphoryl)oxy)methyl)-3,4-dihydroxytetrahydrofuran-2-yl)pyridin-1-ium
3-Pyridinealdehydeadeninedinucleotide
3'-NadP