Tocladesine
HIT212713799
sdf文件结构编辑类似物检索
HIT ID: HIT212713799
Cas No: 41941-56-4
分子式: C10H11ClN5O6P
分子量: 363.65
常用名: Tocladesine
氢键受体数 (HBA): 8
氢键供体数 (HBD): 3
LogP: -2.4781713
IUPAC: (4aR,6R,7R,7aS)-6-(6-amino-8-chloro-9H-purin-9-yl)-2,7-dihydroxy-hexahydro-2lambda5-furo[3,2-d][1,3,2]dioxaphosphinin-2-one
IUPAC: (4aR,6R,7R,7aS)-6-(6-amino-8-chloro-9H-purin-9-yl)-2,7-dihydroxy-hexahydro-2lambda5-furo[3,2-d][1,3,2]dioxaphosphinin-2-one
SMILES: Nc1ncnc2n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c(Cl)nc12
SMILES: Nc1ncnc2n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c(Cl)nc12
InChI key: CLLFEJLEDNXZNR-UUOKFMHZSA-N
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