Chemical Compound

(2s)-4-[1-[(2r,3r,4s,5r)-5-[[[[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxymethyl]-3,4-dihydroxy-tetrahydrofuran-2-yl]-5-carbamoyl-pyridin-1-ium-3-yl]-2-hydroxy-butanoate

CAS Registry Number 68889-85-0
返回搜索 申请报价
(2s)-4-[1-[(2r,3r,4s,5r)-5-[[[[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxymethyl]-3,4-dihydroxy-tetrahydrofuran-2-yl]-5-carbamoyl-pyridin-1-ium-3-yl]-2-hydroxy-butanoate 结构式
Primary record

(2s)-4-[1-[(2r,3r,4s,5r)-5-[[[[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxymethyl]-3,4-dihydroxy-tetrahydrofuran-2-yl]-5-carbamoyl-pyridin-1-ium-3-yl]-2-hydroxy-butanoate

库存
4,206 克
纯度
98.3 %
CAS
68889-85-0

化合物标识与属性

CAS
68889-85-0
PubChem CID
194292
SMILES
C1=C(C=[N+](C=C1C(=O)N)[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)CC[C@@H](C(=O)[O-])O
Canonical SMILES
NC(=O)c1cc(CC[C@H](O)C(=O)[O-])c[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

  • S-Lac-NAD
  • AC1L4XYP
  • RefChem:101659
  • DTXSID00218966
  • AC1Q228J
  • CTK5C8594
  • DTXCID50141457
  • KST-1A8316
  • AR-1A3302
  • CID194292
  • 5-(3-Carboxy-3-hydroxypropyl)nicotinamide adenine dinucleotide
  • 68889-85-0
  • Q27462623
  • (2s)-4-[1-[(2r,3r,4s,5r)-5-[[[[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxymethyl]-3,4-dihydroxy-tetrahydrofuran-2-yl]-5-carbamoyl-pyridin-1-ium-3-yl]-2-hydroxy-butanoate
  • (3s)-5-(3-Carboxy-3-Hydroxypropyl) Nicotinamide-Adenine-Dinucleotide
  • 80353-43-1
  • (2S)-4-[1-[(2R,3R,4S,5R)-5-[[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxymethyl]-3,4-dihydroxyoxolan-2-yl]-5-carbamoylpyridin-1-ium-3-yl]-2-hydroxybutanoate
  • (2S)-4-{1-[(2R,3R,4S,5R)-5-({[{[{[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]oxy}methyl)-3,4-dihydroxyoxolan-2-yl]-5-carbamoylpyridin-1-ium-3-yl}-2-hydroxybutanoate
  • Adenosine 5'-(trihydrogen diphosphate), 5'-5'-ester with 3-(aminocarbonyl)-5-(3-carboxy-3-hydroxypropyl)-1-beta-D-ribofuranosylpyridinium hydroxide, inner salt, (S)-
  • Adenosine--5'-(trihydrogen diphosphate), 5'-5'-ester with 3-(aminocarbonyl)-5-(3-carboxy-3-hydroxypropyl)-1-beta-D-ribofuranosylpyridinium hydroxide, inner salt, (S)-