Chem
J-GLOBAL ID：200907090818547870   Nikkaji number：J645.794K

1QHI

2-アニリノ-9-(4-ヒドロキシブチル)-1H-プリン-6(9H)-オン
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： C15H17N5O2
Molecular formula furigana： C15-H17-N5-O2
Molecular weight： 299.334
InChI： InChI=1S/C15H17N5O2/c21-9-5-4-8-20-10-16-12-13(20)18-15(19-14(12)22)17-11-6-2-1-3-7-11/h1-3,6-7,10,21H,4-5,8-9H2,(H2,17,18,19,22)
InChI key： JHBXNPBKSPYOFT-UHFFFAOYSA-N
SMILES： OCCCCn1cnc2c1nc(Nc1ccccc1)[nH]c2=O
Systematic name  (5)：
  • 9-(4-ヒドロキシブチル)-2-(フェニルアミノ)-1H-プリン-6(9H)-オン
  • 2-アニリノ-9-(4-ヒドロキシブチル)-1H-プリン-6(9H)-オン
  • 2-アニリノ-9-(4-ヒドロキシブチル)-9H-プリン-6(1H)-オン
  • 9-(4-ヒドロキシブチル)-2-(フェニルアミノ)-6,9-ジヒドロ-1H-プリン-6-オン
  • 9-(4-hydroxybutyl)-2-(phenylamino)-6,9-dihydro-1H-purin-6-one
Other name (2)：
  • 2-Anilino-9-(4-hydroxybutyl)-9H-purine-6(1H)-one
  • 1QHI
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