Chemical Compound

1-[(2R,4S,5R)-5-{[({[(2R,3S,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-2-{[({[(2R,3S,5R)-2-{[({[(2R,3S,5R)-2-{[({[(2R,3S,5R)-5-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy}(hydroxy)sulfanylidene-lambda5-phosphanyl)oxy]methyl}-5-(6-amino-9H-purin-9-yl)oxolan-3-yl]oxy}(hydroxy)sulfanylidene-lambda5-phosphanyl)oxy]methyl}-5-(6-amino-9H-purin-9-yl)oxolan-3-yl]oxy}(hydroxy)sulfanylidene-lambda5-phosphanyl)oxy]methyl}oxolan-3-yl]oxy}(hydroxy)sulfanylidene-lambda5-phosphanyl)oxy]methyl}-4-hydroxyoxolan-2-yl]-5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

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1-[(2R,4S,5R)-5-{[({[(2R,3S,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-2-{[({[(2R,3S,5R)-2-{[({[(2R,3S,5R)-2-{[({[(2R,3S,5R)-5-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy}(hydroxy)sulfanylidene-lambda5-phosphanyl)oxy]methyl}-5-(6-amino-9H-purin-9-yl)oxolan-3-yl]oxy}(hydroxy)sulfanylidene-lambda5-phosphanyl)oxy]methyl}-5-(6-amino-9H-purin-9-yl)oxolan-3-yl]oxy}(hydroxy)sulfanylidene-lambda5-phosphanyl)oxy]methyl}oxolan-3-yl]oxy}(hydroxy)sulfanylidene-lambda5-phosphanyl)oxy]methyl}-4-hydroxyoxolan-2-yl]-5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione 结构式
Primary record

1-[(2R,4S,5R)-5-{[({[(2R,3S,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-2-{[({[(2R,3S,5R)-2-{[({[(2R,3S,5R)-2-{[({[(2R,3S,5R)-5-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy}(hydroxy)sulfanylidene-lambda5-phosphanyl)oxy]methyl}-5-(6-amino-9H-purin-9-yl)oxolan-3-yl]oxy}(hydroxy)sulfanylidene-lambda5-phosphanyl)oxy]methyl}-5-(6-amino-9H-purin-9-yl)oxolan-3-yl]oxy}(hydroxy)sulfanylidene-lambda5-phosphanyl)oxy]methyl}oxolan-3-yl]oxy}(hydroxy)sulfanylidene-lambda5-phosphanyl)oxy]methyl}-4-hydroxyoxolan-2-yl]-5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
136865323
SMILES
CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=S)(O)O[C@H]3C[C@@H](O[C@@H]3COP(=S)(O)O[C@H]4C[C@@H](O[C@@H]4COP(=S)(O)O[C@H]5C[C@@H](O[C@@H]5COP(=S)(O)O[C@H]6C[C@@H](O[C@@H]6CO)N7C=NC8=C7N=C(NC8=O)N)N9C=NC1=C(N=CN=C19)N)N1C=NC2=C(N=CN=C21)N)N1C=CC(=NC1=O)N)O
Canonical SMILES
Cc1cn([C@H]2C[C@H](O)[C@@H](COP(O)(=S)O[C@H]3C[C@H](n4ccc(N)nc4=O)O[C@@H]3COP(O)(=S)O[C@H]3C[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(O)(=S)O[C@H]3C[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(O)(=S)O[C@H]3C[C@H](n4cnc5c(=O)[nH]c(N)nc54)O[C@@H]3CO)O2)c(=O)[nH]c1=O

名称与同义词

  • J1.311.700D
  • 1-[(2R,4S,5R)-5-{[({[(2R,3S,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-2-{[({[(2R,3S,5R)-2-{[({[(2R,3S,5R)-2-{[({[(2R,3S,5R)-5-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy}(hydroxy)sulfanylidene-lambda5-phosphanyl)oxy]methyl}-5-(6-amino-9H-purin-9-yl)oxolan-3-yl]oxy}(hydroxy)sulfanylidene-lambda5-phosphanyl)oxy]methyl}-5-(6-amino-9H-purin-9-yl)oxolan-3-yl]oxy}(hydroxy)sulfanylidene-lambda5-phosphanyl)oxy]methyl}oxolan-3-yl]oxy}(hydroxy)sulfanylidene-lambda5-phosphanyl)oxy]methyl}-4-hydroxyoxolan-2-yl]-5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
  • 3 -O-[Hydroxy[[3 -O-[hydroxy[[3 -O-[hydroxy[[3 -O-[hydroxy(5 -thymidyloxy)phosphinothioyl]-2 -deoxy-5 -cytidyl]oxy]phosphinothioyl]-2 -deoxy-5 -adenosyl]oxy]phosphinothioyl]-2 -deoxy-5 -adenosyl]oxy]phosphinothioyl]-2 -deoxyguanosine