Chemical Compound

2-amino-5-(6-{1-[(4-{[4-(6-{2-amino-7-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-oxo-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl}hex-5-yn-1-yl)-1H-1,2,3-triazol-1-yl]methyl}phenyl)methyl]-1H-1,2,3-triazol-4-yl}hex-1-yn-1-yl)-7-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-4-one

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2-amino-5-(6-{1-[(4-{[4-(6-{2-amino-7-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-oxo-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl}hex-5-yn-1-yl)-1H-1,2,3-triazol-1-yl]methyl}phenyl)methyl]-1H-1,2,3-triazol-4-yl}hex-1-yn-1-yl)-7-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-4-one 结构式
Primary record

2-amino-5-(6-{1-[(4-{[4-(6-{2-amino-7-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-oxo-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl}hex-5-yn-1-yl)-1H-1,2,3-triazol-1-yl]methyl}phenyl)methyl]-1H-1,2,3-triazol-4-yl}hex-1-yn-1-yl)-7-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-4-one

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
136695341
SMILES
C1[C@@H]([C@H](O[C@H]1N2C=C(C3=C2N=C(NC3=O)N)C#CCCCCC4=CN(N=N4)CC5=CC=C(C=C5)CN6C=C(N=N6)CCCCC#CC7=CN(C8=C7C(=O)NC(=N8)N)[C@H]9C[C@@H]([C@H](O9)CO)O)CO)O
Canonical SMILES
Nc1nc2c(c(C#CCCCCc3cn(Cc4ccc(Cn5cc(CCCCC#Cc6cn([C@H]7C[C@H](O)[C@@H](CO)O7)c7nc(N)[nH]c(=O)c67)nn5)cc4)nn3)cn2[C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)[nH]1

名称与同义词

  • J3.280.533G
  • 2-amino-5-(6-{1-[(4-{[4-(6-{2-amino-7-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-oxo-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl}hex-5-yn-1-yl)-1H-1,2,3-triazol-1-yl]methyl}phenyl)methyl]-1H-1,2,3-triazol-4-yl}hex-1-yn-1-yl)-7-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-4-one
  • 5,5 -[p-Xylylenebis[(1H-1,2,3-triazole-1,4-diyl)(5-hexyne-1,6-diyl)]]bis[2-amino-7-(2-deoxy-beta-D-erythro-pentofuranosyl)-3H-pyrrolo[2,3-d]pyrimidine-4(7H)-one]