Chemical Compound

9-{5-O-[{[{4-[(3-{[2-(tert-Butylsulfanyl)ethyl]imino}-3-hydroxypropyl)imino]-3,4-dihydroxy-2,2-dimethylbutoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-3-O-phosphonopentofuranosyl}-9H-purin-6-amine

CAS Registry Number 70019-70-4
9-{5-O-[{[{4-[(3-{[2-(tert-Butylsulfanyl)ethyl]imino}-3-hydroxypropyl)imino]-3,4-dihydroxy-2,2-dimethylbutoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-3-O-phosphonopentofuranosyl}-9H-purin-6-amine 结构式
Primary record

9-{5-O-[{[{4-[(3-{[2-(tert-Butylsulfanyl)ethyl]imino}-3-hydroxypropyl)imino]-3,4-dihydroxy-2,2-dimethylbutoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-3-O-phosphonopentofuranosyl}-9H-purin-6-amine

库存
5,224 克
纯度
99.3 %
CAS
70019-70-4

化合物标识与属性

CAS
70019-70-4
PubChem CID
153240
SMILES
CC(C)(C)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O
Canonical SMILES
CC(C)(C)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O

名称与同义词

  • Butyl coenzyme A
  • Coenzyme A, S-butyl-
  • AC1L49YS
  • SCHEMBL18811858
  • C25H44N7O16P3S
  • DTXSID90990264
  • CID153240
  • C25-H44-N7-O16-P3-S
  • tert-Butyl coenzyme A; (Acyl-CoA); [M+H]+;
  • 70019-70-4
  • [[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [4-[[3-(2-tert-butylsulfanylethylamino)-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl] hydrogen phosphate
  • 9-{5-O-[{[{4-[(3-{[2-(tert-Butylsulfanyl)ethyl]imino}-3-hydroxypropyl)imino]-3,4-dihydroxy-2,2-dimethylbutoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-3-O-phosphonopentofuranosyl}-9H-purin-6-amine