具有延长侧链的符合控制的线性和螺旋式碳化合物
Lin Guo1, Oliver J Dutton1, Murat Kucukdisli1
1School of Chemistry, University of Bristol, BS8 1TS, Bristol, U.K.
Journal of the American Chemical Society
|September 30, 2021
概括
灵活的碳化合物链具有可控的结构, 对于药物和材料至关重要. 新的替代模式允许线性或螺旋链上的大型组,为药物向等应用程序提供精确的分子设计.
科学领域:
- 有机化学
- 超分子化学
- 材料科学
背景情况:
- 在分子形状和适应性是关键的应用中,符合性控制的柔性分子至关重要.
- 碳化合物链形状通常由避免同-相互作用,导致线性 (同-反) 或螺旋 (全-同) 结构.
- 纳入大量的替代剂往往会导致不可避免的同相互作用,阻碍构造控制.
研究的目的:
- 识别替代模式,使得大型组可以纳入受结构控制的碳化合物链.
- 为特定应用设计具有可预测的线性或螺旋形状的柔性分子.
- 克服由灵活链中的庞大替代物所造成的形状控制限制.
主要方法:
- 计算分析可以预测形态行为.
- 新型碳化合物的化学合成.
- 核磁共振 (NMR) 光谱用于结构和构造分析.
主要成果:
- 通过采用非理想的阴影形状,在具有乙氧乙烯侧链的同反碳水化合物中达到近线性形状 (95%).
- 证明,在全合成碳化合物中保持螺旋形状需要战略性去除相邻的甲基组.
- 成功地将大型替代物纳入线性和螺旋式碳化合物骨干,同时保持结构完整性.
结论:
- 开发了设计具有大型替代物的可变碳化合物链的策略.
- 能够精确地定位功能组用于多价值结合和合作反应.
- 在与疾病相关的环境中设计针对蛋白质与蛋白质相互作用的分子.
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