Chemical Compound

3'-phosphonatoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(prop-2-enoylsulfanyl)ethyl]amino}propyl)amino]butyl} diphosphate)

CAS Registry Number 5776-58-9
3'-phosphonatoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(prop-2-enoylsulfanyl)ethyl]amino}propyl)amino]butyl} diphosphate) 结构式
Primary record

3'-phosphonatoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(prop-2-enoylsulfanyl)ethyl]amino}propyl)amino]butyl} diphosphate)

库存
3,486 克
纯度
99.2 %
CAS
5776-58-9

化合物标识与属性

CAS
5776-58-9
PubChem CID
45266595
SMILES
CC(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-])[C@H](C(=O)NCCC(=O)NCCSC(=O)C=C)O
Canonical SMILES
C=CC(=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

  • Acryloyl-CoA
  • Acrylyl-CoA
  • Propenoyl-CoA
  • acryloyl-CoA(4-)
  • Acrylyl-Coenzyme A
  • Acryloyl-coenzyme A
  • (Z)-2-enoyl-CoA
  • Coenzyme A, acryloyl-
  • cis-2-enoyl-CoA(4-)
  • CHEBI:57367
  • C24H38N7O17P3S
  • CHEBI:167527
  • C24-H38-N7-O17-P3-S
  • Q27124484
  • 5776-58-9
  • 3'-phosphonatoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(prop-2-enoylsulfanyl)ethyl]amino}propyl)amino]butyl} diphosphate)