Name: APNEA
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212666193
Cas No:89705-21-5
常用名:APNEA
别名:N6-[2-(4-氨基苯基)乙基]腺嘌呤, N6-[2-(4-Aminophenyl)ethyl]adenosine, (2R,3R,4S,5R)-2-[6-[2-(4-aminophenyl)ethylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
别名:N6-[2-(4-氨基苯基)乙基]腺嘌呤, N6-[2-(4-Aminophenyl)ethyl]adenosine, (2R,3R,4S,5R)-2-[6-[2-(4-aminophenyl)ethylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
IUPAC:(2R,3R,4S,5R)-2-(6-{[2-(4-aminophenyl)ethyl]amino}-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
IUPAC:(2R,3R,4S,5R)-2-(6-{[2-(4-aminophenyl)ethyl]amino}-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
InChI key:XTPOZVLRZZIEBW-SCFUHWHPSA-N

分子式:C18H22N6O4
分子量:386.412
氢键供体数 (HBD):5
氢键受体数 (HBA):9
LogP:-0.6050514
SMILES:Nc1ccc(CCNc2ncnc3n(cnc23)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1
SMILES:Nc1ccc(CCNc2ncnc3n(cnc23)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1

APNEA ((2R,3R,4S,5R)-2-[6-[2-(4-aminophenyl)ethylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol) 是腺苷 A3 受体的非选择性激动剂。

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