Chem
J-GLOBAL ID：200907009606510770   Nikkaji number：J377.535F

2-[2-(3,4-Dimethoxyphenyl)ethoxy]adenosine

2-[2-(3,4-ジメトキシフェニル)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： C20H25N5O7
Molecular formula furigana： C20-H25-N5-O7
Molecular weight： 447.448
InChI： InChI=1S/C20H25N5O7/c1-29-11-4-3-10(7-12(11)30-2)5-6-31-20-23-17(21)14-18(24-20)25(9-22-14)19-16(28)15(27)13(8-26)32-19/h3-4,7,9,13,15-16,19,26-28H,5-6,8H2,1-2H3,(H2,21,23,24)/t13-,15-,16-,19-/m1/s1
InChI key： MWGCPRBVVATXOT-NVQRDWNXSA-N
SMILES： COc1ccc(CCOc2nc(N)c3ncn([C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)c3n2)cc1OC
Systematic name  (3)：
  • 2-[2-(3,4-ジメトキシフェニル)エトキシ]アデノシン
  • (2R,3R,4S,5R)-2-{6-アミノ-2-[2-(3,4-ジメトキシフェニル)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-(3,4-dimethoxyphenyl)ethoxy]-9H-purin-9-yl}-5-(hydroxymethyl)oxolane-3,4-diol
Other name (1)：
  • 2-[2-(3,4-Dimethoxyphenyl)ethoxy]adenosine
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