Chem
J-GLOBAL ID：200907073421157330   Nikkaji number：J562.210G

1-Allyl-3,7-dimethyl-8-phenylxanthine

1-アリル-3,7-ジメチル-8-フェニルキサンチン
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： C16H16N4O2
Molecular formula furigana： C16-H16-N4-O2
Molecular weight： 296.330
InChI： InChI=1S/C16H16N4O2/c1-4-10-20-15(21)12-14(19(3)16(20)22)17-13(18(12)2)11-8-6-5-7-9-11/h4-9H,1,10H2,2-3H3
InChI key： DKISSNPEWQAXRA-UHFFFAOYSA-N
SMILES： Cn1c(nc2n(C)c(=O)n(CC=C)c(=O)c12)c1ccccc1
Systematic name  (3)：
  • 1-アリル-3,7-ジメチル-8-フェニルキサンチン
  • 3,7-ジメチル-8-フェニル-1-(プロパ-2-エン-1-イル)-2,3,6,7-テトラヒドロ-1H-プリン-2,6-ジオン
  • 3,7-dimethyl-8-phenyl-1-(prop-2-en-1-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione
Other name (1)：
  • 1-Allyl-3,7-dimethyl-8-phenylxanthine
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