| 403656-41-7

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 肽模拟物
• CAS: 403656-41-7
• 化学式: C₈₂H₁₁₈ClN₁₃O₂₄
• 分子量: 1705.36
• InChiKey: QRXGUALTEXWMOJ-QIRCOCQTSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  120.0
• 可旋转键数：
  42.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  550.51
• 氢给体数：
  18.0
• 氢受体数：
  23.0

反应信息

• 作为反应物：
  描述：

  在 palladium on activated charcoal 氢气 作用下， 以80%的产率得到
  参考文献：
  名称：

  Synthesis and evaluation of novel pseudomycin side-chain analogues. Part 3

  摘要：

  To increase the therapeutic utility of C-18 side-chain bearing pseudomycin analogue 2, we prepared additional analogues and prodrugs of 2 containing further modifications at various positions within its core structure. Each of the newly synthesized derivatives (10-15) exhibited reduced tail vein toxicity relative to the parent compound. Some of the new pseudomycin derivatives (e.g., 14) also showed improved in vivo antifungal activity relative to its corresponding parent compound. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(01)00627-8
• 作为产物：
  描述：

  环丙胺 、 在 O-(benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate 、 N,N-二异丙基乙胺 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 以14%的产率得到
  参考文献：
  名称：

  Synthesis and evaluation of novel pseudomycin side-chain analogues. Part 3

  摘要：

  To increase the therapeutic utility of C-18 side-chain bearing pseudomycin analogue 2, we prepared additional analogues and prodrugs of 2 containing further modifications at various positions within its core structure. Each of the newly synthesized derivatives (10-15) exhibited reduced tail vein toxicity relative to the parent compound. Some of the new pseudomycin derivatives (e.g., 14) also showed improved in vivo antifungal activity relative to its corresponding parent compound. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(01)00627-8