Account Adenine-α-nicotinamide dinucleotide
- Catalog No. :
- ACEJKA122
- CAS No. :
- 7298-93-3
- Molecular Formula :
- C21H27N7O14P2
- Molecular Weight :
- 663.43
IUPAC Name:1-((2S,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
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Product Information
| Product Name | Adenine-α-nicotinamide dinucleotide |
|---|---|
| IUPAC Name | 1-((2S,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 |
| MDL No. | MFCD00134828 |
| Molecular Formula | C21H27N7O14P2 |
| Molecular Weight | 663.43 |
| SMILES | O[C@H]1[C@](O[C@@H]([C@H]1O)COP(OP(OC[C@H]2O[C@@]([N+]3=CC=CC(C(N)=O)=C3)([H])[C@@H]([C@@H]2O)O)([O-])=O)(O)=O)([H])N4C5=NC=NC(N)=C5N=C4 |
| InChI Key | BAWFJGJZGIEFAR-OPDHFMQKSA-N |
| Synonym | ALPHA-NAD;ALPHA-NICOTINAMIDE ADENINE DINUCLEOTIDE;ALPHA-DIPHOSPHOPYRIDINE NUCLEOTIDE;ALPHA-DPN;1-[5-O-[(5'-Adenylyloxy)oxylatophosphinyl]-α-D-ribofuranosyl]-3-(aminocarbonyl)pyridinium;A-nicotinamide adenine dinucleotide;adenosine 5'-(trihydrogen diphosphate), 5'->5'-ester with 3-carbamoyl-1-alpha-D-ribofuranosylpyridinium--ate;α-Diphosphopyridine nucleotide, α-DPN, α-NAD |
| CAS No. | 7298-93-3 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H315-H319-H335
- Precautionary Statement(s)
- P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P362-P403+P233-P501
Synthetic Route by SureRoute
2. ACEJKA122 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
