| 114563-69-8

• 分子结构分类: 有机化合物 - 核苷、核苷酸和类似物 - 嘌呤核苷
• CAS: 114563-69-8
• 化学式: C₃₃H₃₇N₁₃O₁₀
• 分子量: 775.738
• InChiKey: CISXZWJNOLXQCX-PYBMJSCXSA-N

物化性质

• 密度：
  2.16±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  -2.65
• 重原子数：
  56.0
• 可旋转键数：
  9.0
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  341.69
• 氢给体数：
  10.0
• 氢受体数：
  21.0

反应信息

• 作为产物：
  描述：

  丝裂霉素 C 、 2'-脱氧鸟苷 在 sodium dithionite 、 氧气 作用下， 以 水 为溶剂， 生成
  参考文献：
  名称：

  Nucleotide derivatives of 2,7-diaminomitosene

  摘要：

  Treatment of mitomycin C with pyrimidine nucleotides in acidic media produced derivatives of 2,7-diaminomitosene in which C-1 was covalently bound to the phosphate group of the nucleotides. On reduction, these derivatives liberated the nucleotides and a mitomycin intermediate that alkylated DNA. Their reduction in the presence of 2'-deoxyguanosine produced some bifunctional alkylation as did mitomycin C. They were readily taken up by L1210 leukemia cells, in which they showed potent cytotoxicity. These properties suggest that they are acting as prodrugs capable of conversion into two active species. The uridylate derivative showed activity comparable to that of mitomycin C against P-388 leukemia in mice.

  DOI：

  10.1021/jm00403a016