Chem
J-GLOBAL ID：200907009035219436   Nikkaji number：J401.156B

7-(2-Acetoxyethyl)-1,3-dimethylxanthine

7-(2-アセトキシエチル)-1,3-ジメチルキサンチン
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： C11H14N4O4
Molecular formula furigana： C11-H14-N4-O4
Molecular weight： 266.257
InChI： InChI=1S/C11H14N4O4/c1-7(16)19-5-4-15-6-12-9-8(15)10(17)14(3)11(18)13(9)2/h6H,4-5H2,1-3H3
InChI key： CQKZJBMFMGGBHJ-UHFFFAOYSA-N
SMILES： CC(=O)OCCn1cnc2n(C)c(=O)n(C)c(=O)c12
Systematic name  (4)：
  • 7-(2-アセトキシエチル)-1,3-ジメチルキサンチン
  • 1,3-ジメチル-2,6-ジオキソ-1,2,3,6-テトラヒドロ-7H-プリン-7-エタノールアセタート
  • 2-(1,3-ジメチル-2,6-ジオキソ-2,3,6,7-テトラヒドロ-1H-プリン-7-イル)エチル アセタート
  • 2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl acetate
Other name (2)：
  • 7-(2-Acetoxyethyl)-1,3-dimethylxanthine
  • 1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purine-7-ethanol acetate
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