Chemical Compound

1-[(2R,3R,4S,5R)-5-[[[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxymethyl]-3,4-dihydroxyoxolan-2-yl]pyridin-1-ium-3-carboxylic acid

CAS Registry Number 5502-96-5
1-[(2R,3R,4S,5R)-5-[[[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxymethyl]-3,4-dihydroxyoxolan-2-yl]pyridin-1-ium-3-carboxylic acid 结构式
Primary record

1-[(2R,3R,4S,5R)-5-[[[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxymethyl]-3,4-dihydroxyoxolan-2-yl]pyridin-1-ium-3-carboxylic acid

库存
704 克
纯度
99.1 %
CAS
5502-96-5

化合物标识与属性

CAS
5502-96-5
PubChem CID
123953
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)OP(=O)(O)O)O)O)O)C(=O)O
Canonical SMILES
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H]([n+]3cccc(C(=O)O)c3)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1OP(=O)(O)O

名称与同义词

  • NAADP
  • NAADP+
  • beta-NAADP
  • NAADP tetrasodium salt
  • AC1L3XLY
  • D07RTQ
  • NAADP(1+)
  • GTPL2450
  • SCHEMBL20162473
  • SCHEMBL29355697
  • CHEBI:76072
  • QOTXBMGJKFVZRD-HISDBWNOSA-O
  • Nicotinic acid adenine dinucleotide phosphate
  • C21H27N6O18P3
  • ZINC8295089
  • CID123953
  • Nicotinate adenine dinucleotide phosphate
  • nicotinate-adenine dinucleotide phosphate
  • nicotinic acid-adenine dinucleotide phosphate
  • C21-H27-N6-O18-P3
  • NS00074253
  • C13051
  • nicotinic acid-adenine dinucleotide phosphate(1+)
  • Q905651
  • 1-[(2R,3R,4S,5R)-5-[[[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxymethyl]-3,4-dihydroxyoxolan-2-yl]pyridin-1-ium-3-carboxylic acid
  • 5502-96-5
  • 119299-06-8
  • [[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-oxidanyl-4-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2R,3S,4R,5R)-5-(3-carboxypyridin-1-ium-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl phosphate
  • [[(2r,3r,4r,5r)-5-(6-Aminopurin-9-Yl)-3-Oxidanyl-4-Phosphonooxy-Oxolan-2-Yl]methoxy-Oxidanyl-Phosphoryl][(2r,3s,4r,5r)-5-(3-Carboxypyridin-1-Ium-1-Yl)-3,4-Bis(Oxidanyl)oxolan-2-Yl]methyl Phosphate
  • 2'-O-phosphonoadenosine 5'-{3-[1-(3-carboxypyridinio)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate}
  • DN4
  • Siloxanes and Silicones, di-Me, reaction products with N-3-(trimethoxysilyl)propylcyclohexanamine