| 1449685-08-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• CAS: 1449685-08-8
• 化学式: C₇₇H₉₇N₉O₁₆
• 分子量: 1404.67
• InChiKey: NAKYSCQRJASTQA-PJRXRSFSSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.9
• 重原子数：
  102.0
• 可旋转键数：
  40.0
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  270.18
• 氢给体数：
  4.0
• 氢受体数：
  20.0

反应信息

• 作为产物：
  描述：

  、 2-(3-((R)-3-(3,4-dimethoxyphenyl)-1-(((S)-1-((S)-2-(3,4,5-trimethoxyphenyl)butanoyl)piperidine-2-carbonyl)oxy)propyl)phenoxy)acetic acid 在 O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate 、 N,N-二异丙基乙胺 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 2.08h， 以55 mg的产率得到
  参考文献：
  名称：

  Synthetic Self-Localizing Ligands That Control the Spatial Location of Proteins in Living Cells

  摘要：

  Small-molecule ligands that control the spatial location of proteins in living cells would be valuable tools for regulating biological systems. However, the creation of such molecules remains almost unexplored because of the lack of a design methodology. Here we introduce a conceptually new type of synthetic ligands, self-localizing ligands (SLLs), which spontaneously localize to specific subcellular regions in mammalian cells. We show that SLLs bind their target proteins and relocate (tether) them rapidly from the cytoplasm to their targeting sites, thus serving as synthetic protein translocators. SLL-induced protein translocation enables us to manipulate diverse synthetic/endogenous signaling pathways. The method is also applicable to reversible protein translocation and allows control of multiple proteins at different times and locations in the same cell. These results demonstrate the usefulness of SLLs in the spatial (and temporal) control of intracellular protein distribution and biological processes, opening a new direction in the design of small-molecule tools or drugs for cell regulation.

  DOI：

  10.1021/ja4046907