Name: 8-Chloro-ATP
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT219158485
Cas No:185341-71-3
常用名:8-Chloro-ATP
别名:8-Cl-cAMP, 8-Cl-ATP, 8-Chloroadenosine 5′-triphosphate, 8-Chloroadenosine 5′-(tetrahydrogen triphosphate), 8-Chloroadenosin-5′-triphosphate
别名:8-Cl-cAMP, 8-Cl-ATP, 8-Chloroadenosine 5′-triphosphate, 8-Chloroadenosine 5′-(tetrahydrogen triphosphate), 8-Chloroadenosin-5′-triphosphate
IUPAC:({[({[(2R,3S,4R,5R)-5-(6-amino-8-chloro-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid
IUPAC:({[({[(2R,3S,4R,5R)-5-(6-amino-8-chloro-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid
InChI key:NXKRKKQPDYYKFT-UUOKFMHZSA-N

分子式:C10H15ClN5O13P3
分子量:541.62
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:Nc1ncnc2n([C@@H]3O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]3O)c(Cl)nc12
SMILES:Nc1ncnc2n([C@@H]3O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]3O)c(Cl)nc12

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