Chemical Compound

(2R)-4-(((((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)-N-(2-((2-(1,4-dioxidonaphthalene-2-carbonylsulfanyl)ethyl)carboximidato)ethyl)-2-hydroxy-3,3-dimethylbutanecarboximidate

CAS Registry Number 875613-67-5
返回搜索 申请报价
(2R)-4-(((((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)-N-(2-((2-(1,4-dioxidonaphthalene-2-carbonylsulfanyl)ethyl)carboximidato)ethyl)-2-hydroxy-3,3-dimethylbutanecarboximidate 结构式
Primary record

(2R)-4-(((((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)-N-(2-((2-(1,4-dioxidonaphthalene-2-carbonylsulfanyl)ethyl)carboximidato)ethyl)-2-hydroxy-3,3-dimethylbutanecarboximidate

库存
1,394 克
纯度
98.8 %
CAS
875613-67-5

化合物标识与属性

CAS
875613-67-5
PubChem CID
44140569
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)C4=C(C5=CC=CC=C5C(=C4)O)O)O
Canonical SMILES
CC(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)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)c1cc(O)c2ccccc2c1O

名称与同义词

  • DHNA-CoA
  • 1,4-Dihydroxy-2-naphthoyl-CoA
  • RefChem:1053282
  • CHEBI:52668
  • orb3022272
  • SCHEMBL1037562
  • SCHEMBL29702993
  • 1,4-dihydroxy-2-naphthoyl-coenzyme A
  • DHNA-CoA; (Acyl-CoA); [M+H]+;
  • C15547
  • Q27123541
  • 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(1,4-dihydroxy-2-naphthoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
  • 875613-67-5
  • (2R)-4-(((((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)-N-(2-((2-(1,4-dioxidonaphthalene-2-carbonylsulfanyl)ethyl)carboximidato)ethyl)-2-hydroxy-3,3-dimethylbutanecarboximidate
  • 3'-phosphoadenosine 5'-(3-((3R)-4-((3-((2-((1,4-dihydroxy-2-naphthoyl)sulfanyl)ethyl)amino)-3-oxopropyl)amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate)