3,7-bis(methyl-d3)-3,7-dihydro-1H-purine-2,6-dione 3,7-双(甲基-d3)-3,7-二氢-1H-嘌呤-2,6-二酮

CAS 117490-40-1 MFCD09952291

化学结构图

117490-40-1
SMILES: [2H]C([2H])([2H])N1C=NC2=C1C(=O)NC(=O)N2C([2H])([2H])[2H]

化学属性

Mol. FormulaC7D6H2N4O2
Mol. Weight186.20
Melting Point345 °C

别名和识别编码

Chemical Name3,7-bis(methyl-d3)-3,7-dihydro-1H-purine-2,6-dione
CAS Number117490-40-1
Synonym Santheose-d6 3,7-二甲基黄嘌呤-d6 (二甲基-d6) 3,7-Dimethylxanthine-d6 Thesal-d6 Diurobromine-d6 Teobromin-d6 3,7-Dihydro-3,7-di(methyl-d3)-1H-purine-2,6-dione NSC 5039-d6 2,6-二羟基-3,7-二甲基嘌呤-d6 (二甲基-d6) 3,7-二甲基-1H-嘌呤-2,6-二酮-d6 (二甲基-d6) 可可碱-d6 (二甲基-d6)
MDL NumberMFCD09952291
Chemical Name Translation3,7-双(甲基-d3)-3,7-二氢-1H-嘌呤-2,6-二酮
PubChem Substance ID329762552
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分类

  • Isotope Labelled Compounds
  • {SNA} Bioactive Compounds, Caffeine and Caffeine Metabolites, Stable Isotopes
  • {SNA} Caffeine and Caffeine Metabolites, Metabolites and Bioactive Compounds, Stable Isotopes
  • Pharmaceuticals
  • Intermediates & Fine Chemicals,
  • Metabolites & Impurities

产品应用

  • A labelled metabolite of Caffeine.

相关文献及参考

  • Burkart, V., et al.: Nat. Med., 5, 314 (1999),
  • Suto, M., et al.: Anticancer Drug Des., 6, 107 (1991),

安全信息

GHS Symbol
WGK Germany1
Hazard statements
  • H302 Harmful if swallowed 吞食有害
Signal word Warning
Hazard Codes Xn
Risk Statements
  • R22 Harmful if swallowed 吞咽有害

系列性分类

  1. Analytical & Chromatography 分析化学与色谱
  2. Stable Isotopes 稳定同位素
  3. Stable Isotope Labeled Vitamins, Steroids, Hormones and Caffeine Metabolites
  4. Stable Isotope Labeled Caffeine and Caffeine Metabolites

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