Chemical Compound

4-({[17-({[3-({[(17-{[({17-[({[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-2-{[({[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-4-hydroxy-2-[(phosphonooxy)methyl]oxolan-3-yl]oxy}(hydroxy)phosphoryl)oxy]methyl}-4-hydroxyoxolan-3-yl]oxy}phosphonoyl)oxy]-3,6,9,12,15-pentaoxaheptadecan-1-yl}oxy)phosphonoyl]oxy}-3,6,9,12,15-pentaoxaheptadecan-1-yl)oxy]phosphonoyl}oxy)-1-(2-nitrophenyl)propoxy]phosphonoyl}oxy)-3,6,9,12,15-pentaoxaheptadecan-1-yl]oxy}phosphonoyl)butanoic acid

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4-({[17-({[3-({[(17-{[({17-[({[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-2-{[({[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-4-hydroxy-2-[(phosphonooxy)methyl]oxolan-3-yl]oxy}(hydroxy)phosphoryl)oxy]methyl}-4-hydroxyoxolan-3-yl]oxy}phosphonoyl)oxy]-3,6,9,12,15-pentaoxaheptadecan-1-yl}oxy)phosphonoyl]oxy}-3,6,9,12,15-pentaoxaheptadecan-1-yl)oxy]phosphonoyl}oxy)-1-(2-nitrophenyl)propoxy]phosphonoyl}oxy)-3,6,9,12,15-pentaoxaheptadecan-1-yl]oxy}phosphonoyl)butanoic acid 结构式
Primary record

4-({[17-({[3-({[(17-{[({17-[({[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-2-{[({[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-4-hydroxy-2-[(phosphonooxy)methyl]oxolan-3-yl]oxy}(hydroxy)phosphoryl)oxy]methyl}-4-hydroxyoxolan-3-yl]oxy}phosphonoyl)oxy]-3,6,9,12,15-pentaoxaheptadecan-1-yl}oxy)phosphonoyl]oxy}-3,6,9,12,15-pentaoxaheptadecan-1-yl)oxy]phosphonoyl}oxy)-1-(2-nitrophenyl)propoxy]phosphonoyl}oxy)-3,6,9,12,15-pentaoxaheptadecan-1-yl]oxy}phosphonoyl)butanoic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177426898
SMILES
C1=CC=C(C(=C1)C(CCO[P+](=O)OCCOCCOCCOCCOCCOCCO[P+](=O)OCCOCCOCCOCCOCCOCCO[P+](=O)O[C@@H]2[C@H](O[C@H]([C@@H]2O)N3C=CC(=NC3=O)N)COP(=O)(O)O[C@@H]4[C@H](O[C@H]([C@@H]4O)N5C=CC(=NC5=O)N)COP(=O)(O)O)O[P+](=O)OCCOCCOCCOCCOCCOCCO[P+](=O)CCCC(=O)O)[N+](=O)[O-]
Canonical SMILES
Nc1ccn([C@@H]2O[C@H](COP(=O)(O)O[C@H]3[C@@H](O)[C@H](n4ccc(N)nc4=O)O[C@@H]3COP(=O)(O)O)[C@@H](O[P+](=O)OCCOCCOCCOCCOCCOCCO[P+](=O)OCCOCCOCCOCCOCCOCCO[P+](=O)OCCC(O[P+](=O)OCCOCCOCCOCCOCCOCCO[P+](=O)CCCC(=O)O)c3ccccc3[N+](=O)[O-])[C@H]2O)c(=O)n1

名称与同义词

  • J1.450.213K
  • 3 -O-[3 -O-[[17-[[17-[[3-[[17-[(4-Hydroxy-4-oxobutyl)phosphinyloxy]-3,6,9,12,15-pentaoxaheptadecane-1-yloxy]phosphinyloxy]-3-(2-nitrophenyl)propoxy]phosphinyloxy]-3,6,9,12,15-pentaoxaheptadecane-1-yloxy]phosphinyloxy]-3,6,9,12,15-pentaoxaheptadecane-1-yloxy]phosphinyl]-5 -cytidylyl]-5 -cytidylic acid
  • 4-({[17-({[3-({[(17-{[({17-[({[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-2-{[({[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-4-hydroxy-2-[(phosphonooxy)methyl]oxolan-3-yl]oxy}(hydroxy)phosphoryl)oxy]methyl}-4-hydroxyoxolan-3-yl]oxy}phosphonoyl)oxy]-3,6,9,12,15-pentaoxaheptadecan-1-yl}oxy)phosphonoyl]oxy}-3,6,9,12,15-pentaoxaheptadecan-1-yl)oxy]phosphonoyl}oxy)-1-(2-nitrophenyl)propoxy]phosphonoyl}oxy)-3,6,9,12,15-pentaoxaheptadecan-1-yl]oxy}phosphonoyl)butanoic acid