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, sodium salt
- Catalog No. :
- ACSIUO024
- CAS No. :
- 20111-18-6
- Molecular Formula :
- C21H26N7NaO14P2
- Molecular Weight :
- 685.41
IUPAC Name:-
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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, sodium salt |
|---|---|
| MDL No. | MFCD00148917 |
| Molecular Formula | C21H26N7NaO14P2 |
| Molecular Weight | 685.41 |
| SMILES | O[C@H]1[C@@H](O[C@@H]([C@H]1O)COP(OP(OC[C@H]2O[C@@H]([N+]3=CC=CC(C(N)=O)=C3)[C@@H]([C@@H]2O)O)([O-])=O)([O-])=O)N4C5=NC=NC(N)=C5N=C4.[Na+] |
| InChI Key | OGCURMAMSJFXSG-QYZPTAICSA-M |
| Synonym | DPN | NAD | B1N53L892B | Nad sodium salt | NAD | -DPN (sodium salt);-NAD (sodium salt);-Nicotinamide Adenine Dinucleotide (sodium salt) | ADENOSINE 5'-(TRIHYDROGEN DIPHOSPHATE), P'->5'-ESTER WITH 3-(AMINOCARBONYL)-1-.BETA.-D-RIBOFURANOSYLPYRIDINIUM, INNER |
| CAS No. | 20111-18-6 |
| PubChem CID | 72710628 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H302-H371
- Precautionary Statement(s)
- P260-P264-P270-P308+P311-P405-P501
Synthetic Route by SureRoute
2. ACSIUO024 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
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
Nad lithium salt