Chemical Compound

3-Acetylpyridine hypoxanthine dinucleotide

CAS Registry Number 4002-09-9
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3-Acetylpyridine hypoxanthine dinucleotide chemical structure
Primary Record

3-Acetylpyridine hypoxanthine dinucleotide

In stock
4,873 g
Purity
99.3 %
CAS
4002-09-9

Compound Identifiers & Properties

CAS
4002-09-9
PubChem CID
136192482
SMILES
CC(=O)C1=C[N+](=CC=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)([O-])OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C4N=CNC5=O)O)O)O)O
Canonical SMILES
CC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)([O-])OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(=O)[nH]cnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1

Names & Synonyms

  • 3-Acetylpyridine hypoxanthine dinucleotide
  • 3-Acetylpyridine-hypoxanthine dinucleotide
  • 3-ACETYLPYRIDINEHYPOXANTHINEDINUCLEOTIDE
  • 4002-09-9
  • [(2R,3S,4R,5R)-5-(3-acetylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl [[(2R,3S,4R,5R)-3,4-dihydroxy-5-(6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphate
  • 3-acetyl-1-[(2R,3R,4S,5R)-5-[({[(2R,3S,4R,5R)-3,4-dihydroxy-5-(6-oxo-3H-purin-9-yl)oxolan-2-yl]methoxy(hydroxy)phosphoryl phosphonato}oxy)methyl]-3,4-dihydroxyoxolan-2-yl]-1$l^{5}-pyridin-1-ylium