Account 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)-3-carbamoylpyridin-1-ium tetrahydrate
- Catalog No. :
- ACLXZL361
- CAS No. :
- 282730-13-6
- Molecular Formula :
- C21H35N7O18P2
- Molecular Weight :
- 735.49
IUPAC Name: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)-3-carbamoylpyridin-1-ium tetrahydrate
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Product Information
| Product Name | 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)-3-carbamoylpyridin-1-ium tetrahydrate |
|---|---|
| IUPAC Name | 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)-3-carbamoylpyridin-1-ium tetrahydrate |
| MDL No. | MFCD00150381 |
| Molecular Formula | C21H35N7O18P2 |
| Molecular Weight | 735.49 |
| SMILES | O[C@@H]1[C@@H]([C@H](O[C@H]1N2C=NC3=C(N)N=CN=C23)COP(O)(OP([O-])(OC[C@@H]4[C@@H](O)[C@H]([C@@H](O4)[N+]5=CC=CC(C(N)=O)=C5)O)=O)=O)O.[H]O[H].[H]O[H].[H]O[H].[H]O[H] |
| InChI Key | AWWDDIGNQVLAEO-ITGWJZMWSA-N |
| Synonym | Diphosphopyridine dinucleotide;beta-Nicotinamideadeninedinucleotidetetrahydratecrystalline;beta-NicotinaMide adenine dinucleotide tetrahydrate, crystalline, 98+% 250MG;BETA-NICOTINAMIDE ADENINE DINUCLEOTIDE TETRAHYDRATE, CRYSTALLINE, 98+%;Beta-nicotinamide adenine dinucleotide tetrahydrate, 98+%, crystalline |
| CAS No. | 282730-13-6 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501
Synthetic Route by SureRoute
2. ACLXZL361 Molecular Building Block Synthetic Route
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)-3-carbamoylpyridin-1-ium, sodium salt
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)-3-carbamoylpyridin-1-ium
1-((2S,3S,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)-3-carbamoylpyridin-1-ium
