Chemical Compound

S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 4-acetamidobutanethioate

CAS Registry Number 74833-91-3
S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 4-acetamidobutanethioate 结构式
Primary record

S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 4-acetamidobutanethioate

库存
7,479 克
纯度
98.9 %
CAS
74833-91-3

化合物标识与属性

CAS
74833-91-3
PubChem CID
194623
SMILES
CC(=O)NCCCC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O
Canonical SMILES
CC(=O)NCCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O

名称与同义词

  • 4-Acetamidobutyryl-coa
  • 4-Aab-coa
  • 4-Acetamidobutanoyl-CoA
  • 4-Acetamidobutyryl-coenzyme A
  • AC1L4YLJ
  • Coenzyme A, 4-acetamidobutyryl-
  • 4-acetamidobutanoyl-coenzyme A
  • SCHEMBL29536936
  • CHEBI:28684
  • CTK5E0565
  • DTXSID90996347
  • CID194623
  • LMFA07050261
  • 4-Aab-CoA; (Acyl-CoA); [M+H]+;
  • Coenzyme A, S-(4-(acetylamino)butanoate)
  • 74833-91-3
  • C03357
  • Coenzyme A,S-[4-(acetylamino)butanoate] (9CI)
  • Q27103836
  • 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-acetamidobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
  • S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 4-acetamidobutanethioate
  • 5'-O-{Hydroxy[(hydroxy{[(17R)-2,12,16,17-tetrahydroxy-18,18-dimethyl-7-oxo-8-thia-3,11,15-triazanonadeca-2,11,15-trien-19-yl]oxy}phosphoryl)oxy]phosphoryl}adenosine 3'-(dihydrogen phosphate)
  • 9-{5-O-[Hydroxy({hydroxy[(2,12,16,17-tetrahydroxy-18,18-dimethyl-7-oxo-8-thia-3,11,15-triazanonadeca-2,11,15-trien-19-yl)oxy]phosphoryl}oxy)phosphoryl]-3-O-phosphonopentofuranosyl}-9H-purin-6-amine