Chem
J-GLOBAL ID：200907096296258137   Nikkaji number：J377.516J

2-(4-Phenylbutoxy)adenosine

2-(4-フェニルブトキシ)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： C20H25N5O5
Molecular formula furigana： C20-H25-N5-O5
Molecular weight： 415.450
InChI： InChI=1S/C20H25N5O5/c21-17-14-18(25(11-22-14)19-16(28)15(27)13(10-26)30-19)24-20(23-17)29-9-5-4-8-12-6-2-1-3-7-12/h1-3,6-7,11,13,15-16,19,26-28H,4-5,8-10H2,(H2,21,23,24)/t13-,15-,16-,19-/m1/s1
InChI key： VZCKGCMWUBEJIH-NVQRDWNXSA-N
SMILES： Nc1nc(OCCCCc2ccccc2)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
Systematic name  (3)：
  • 2-(4-フェニルブトキシ)アデノシン
  • (2R,3R,4S,5R)-2-[6-アミノ-2-(4-フェニルブトキシ)-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-(4-phenylbutoxy)-9H-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Other name (1)：
  • 2-(4-Phenylbutoxy)adenosine
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