| 139365-43-8

• 分子结构分类: 有机化合物 - 有机氧化合物
• CAS: 139365-43-8
• 化学式: C₄₈H₈₁NO₃₅
• 分子量: 1232.16
• InChiKey: ZOLPTPXTADLQSM-JPTLVWLKSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -13.53
• 重原子数：
  84.0
• 可旋转键数：
  12.0
• 环数：
  21.0
• sp3杂化的碳原子比例：
  0.98
• 拓扑面积：
  562.92
• 氢给体数：
  21.0
• 氢受体数：
  35.0

反应信息

• 作为产物：
  描述：

  N-羟基琥珀酰亚胺己酸酯 、 单-6-O-氨基-Β-环糊精 以 N,N-二甲基甲酰胺 为溶剂， 反应 4.0h， 生成
  参考文献：
  名称：

  NMR investigations of the conformation of new cyclodextrin-based amphiphilic transporters for hydrophobic drugs: molecular lollipops

  摘要：

  Amphiphilic compounds, obtained by grafting aliphatic acids onto a modified cyclodextrin, have been synthesized and studied by solution NMR. The large chain-length dependence of the NMR spectra in aqueous media is explained by the possible formation of auto-inclusion complexes. This process has been evidenced by extensive NMR experiments and by competition with potential guests. This new class of molecules ("lollipops") provides important information for the optimization of a design for amphiphilic transporters to be included in organized phases such as micelles or liposomes.

  DOI：

  10.1016/0022-2860(92)87087-c