Chemical Compound

[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5S)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate

CAS Registry Number 7298-93-3
[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5S)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate 结构式
Primary record

[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5S)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate

库存
6,173 克
纯度
99.7 %
CAS
7298-93-3

化合物标识与属性

CAS
7298-93-3
PubChem CID
16219772
SMILES
C1=CC(=C[N+](=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=C(N=CN=C54)N)O)O)O)O)C(=O)N
Canonical SMILES
NC(=O)c1ccc[n+]([C@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1

名称与同义词

  • alpha-NAD
  • alpha-NAD(+)
  • alpha-Diphosphopyridine nucleotide
  • SCHEMBL29516506
  • CHEBI:77173
  • C21H27N7O14P2
  • EINECS 230-738-0
  • ZINC49771137
  • Adenine-alpha-nicotinamide dinucleotide
  • C21-H27-N7-O14-P2
  • Q27146738
  • [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5S)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate
  • 7298-93-3
  • 8NA
  • Adenosine 5'-(trihydrogen diphosphate), 5',5'-ester with 3-carbamoyl-1-alpha-D-ribofuranosylpyridiniumate
  • Adenosine 5'-(trihydrogen diphosphate), 5'5'-ester with 3-carbamoyl-1-alpha-D-ribofuranosylpyridinium--ate