Chem
J-GLOBAL ID：200907066306532821   Nikkaji number：J377.520H

2-[2-(4-Fluorophenyl)ethoxy]adenosine

2-[2-(4-フルオロフェニル)エトキシ]アデノシン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C18H20FN5O5
Molecular formula furigana： C18-H20-F-N5-O5
Molecular weight： 405.386
InChI： InChI=1S/C18H20FN5O5/c19-10-3-1-9(2-4-10)5-6-28-18-22-15(20)12-16(23-18)24(8-21-12)17-14(27)13(26)11(7-25)29-17/h1-4,8,11,13-14,17,25-27H,5-7H2,(H2,20,22,23)/t11-,13-,14-,17-/m1/s1
InChI key： WJXSIJUIBOTFHQ-LSCFUAHRSA-N
SMILES： Nc1nc(OCCc2ccc(F)cc2)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
Systematic name  (3)：
  • 2-[2-(4-フルオロフェニル)エトキシ]アデノシン
  • (2R,3R,4S,5R)-2-{6-アミノ-2-[2-(4-フルオロフェニル)エトキシ]-9H-プリン-9-イル}-5-(ヒドロキシメチル)オキソラン-3,4-ジオール
  • (2R,3R,4S,5R)-2-{6-amino-2-[2-(4-fluorophenyl)ethoxy]-9H-purin-9-yl}-5-(hydroxymethyl)oxolane-3,4-diol
Other name (1)：
  • 2-[2-(4-Fluorophenyl)ethoxy]adenosine
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