Name: pppApG
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT217583748
Cas No:68892-47-7
常用名:pppApG
IUPAC:({[({[(2R,3S,4R,5R)-3-[({[(2R,3S,4R,5R)-5-(2-amino-6-oxo-6,9-dihydro-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]-5-(6-amino-9H-purin-9-yl)-4-hydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid
IUPAC:({[({[(2R,3S,4R,5R)-3-[({[(2R,3S,4R,5R)-5-(2-amino-6-oxo-6,9-dihydro-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]-5-(6-amino-9H-purin-9-yl)-4-hydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid
InChI key:DTYOICBSSHTIFB-INFSMZHSSA-N

分子式:C20H28N10O20P4
分子量:852.389
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:Nc1nc(=O)c2ncn([C@@H]3O[C@H](COP(O)(=O)O[C@@H]4[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]([C@@H]4O)n4cnc5c(N)ncnc45)[C@@H](O)[C@H]3O)c2[nH]1
SMILES:Nc1nc(=O)c2ncn([C@@H]3O[C@H](COP(O)(=O)O[C@@H]4[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]([C@@H]4O)n4cnc5c(N)ncnc45)[C@@H](O)[C@H]3O)c2[nH]1

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