| 1084756-36-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 咪唑并嘧啶类
• CAS: 1084756-36-4
• 化学式: C₂₈H₅₂N₇O₁₉P₃
• 分子量: 883.678
• InChiKey: RWXHTBPUCOXTMY-ISJGIBHGSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.75
• 重原子数：
  57.0
• 可旋转键数：
  33.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.79
• 拓扑面积：
  344.41
• 氢给体数：
  7.0
• 氢受体数：
  21.0

反应信息

• 作为反应物：
  描述：

  在 Tris-Cl buffer 、 水 、 magnesium sulfate 作用下， 生成 、 2'-脱氧腺苷-5'-二磷酸酯
  参考文献：
  名称：

  Synthesis and Stability of Novel Terminal Phosphate-Labeled Nucleotides

  摘要：

  Novel compounds consisting of a nucleotide triphosphate labeled with a PEG linker and various terminal groups attached to the -phosphate of the nucleotide were constructed for use in efforts to produce a new class of DNA sequencer. The stability of these novel compounds was investigated to determine their utility as sequencing reagents. Hydrolysis rate constants were measured for both the natural nucleoside triphosphate dATP and novel dATP derivatives. The -labeled dATP was approximately 20-fold more stable to hydrolysis than dATP.

  DOI：

  10.1080/15257770701571768
• 作为产物：
  描述：

  、 溶剂黄146 在 MES buffer 、 盐酸-N-乙基-Nˊ-(3-二甲氨基丙基)碳二亚胺 作用下， 反应 0.5h， 以30%的产率得到
  参考文献：
  名称：

  Synthesis and Stability of Novel Terminal Phosphate-Labeled Nucleotides

  摘要：

  Novel compounds consisting of a nucleotide triphosphate labeled with a PEG linker and various terminal groups attached to the -phosphate of the nucleotide were constructed for use in efforts to produce a new class of DNA sequencer. The stability of these novel compounds was investigated to determine their utility as sequencing reagents. Hydrolysis rate constants were measured for both the natural nucleoside triphosphate dATP and novel dATP derivatives. The -labeled dATP was approximately 20-fold more stable to hydrolysis than dATP.

  DOI：

  10.1080/15257770701571768