Account pppApA
- Catalog No. :
- ACHAIL193
- CAS No. :
- 17730-98-2
- Molecular Formula :
- C20H28N10O19P4
- Molecular Weight :
- 836.39
IUPAC Name:((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3-(((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)-4-hydroxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate
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Product Information
| Product Name | pppApA |
|---|---|
| IUPAC Name | ((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3-(((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)-4-hydroxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate |
| Molecular Formula | C20H28N10O19P4 |
| Molecular Weight | 836.39 |
| SMILES | NC1=C2N=CN([C@@H]3O[C@H](COP(=O)(O)O[C@H]4[C@@H](O)[C@H](N5C=NC6=C(N)N=CN=C65)O[C@@H]4COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)C2=NC=N1 |
| InChI Key | QHDLNUXBTZGUIH-XPWFQUROSA-N |
| Synonym | Adenosine, 5'-O-[hydroxy[[hydroxy(phosphonooxy)phosphinyl]oxy]phosphinyl]adenylyl-(3'→5')-;Adenosine 5'-(tetrahydrogen triphosphate), adenylyl-(5'→3')- |
| CAS No. | 17730-98-2 |
Synthetic Route by SureRoute
2. ACHAIL193 Molecular Building Block Synthetic Route
((2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate, disodium salt
Magnesium (2R,3R,4R,5R)-2-(6-amino-9H-purin-9-yl)-5-(((hydroxy((hydroxy(phosphonooxy)phosphoryl)oxy)phosphoryl)oxy)methyl)tetrahydrofuran-3,4-bis(olate)
(5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate