cholest-5-en-3β-yl 6-aminohexyl ether hydrochloride | 103003-28-7

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 类固醇和类固醇衍生物
• 英文名称: cholest-5-en-3β-yl 6-aminohexyl ether hydrochloride
• CAS: 103003-28-7
• 化学式: C₃₃H₅₉NO*ClH
• 分子量: 522.299
• InChiKey: YRDMBHMSSCTJFU-JPIPMGRLSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.35
• 重原子数：
  36.0
• 可旋转键数：
  12.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.94
• 拓扑面积：
  35.25
• 氢给体数：
  1.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  cholest-5-en-3β-yl 6-aminohexyl ether hydrochloride 、 N,N'-硫羰基二咪唑 在 N,N-二异丙基乙胺 作用下， 以 乙醚 为溶剂， 反应 18.0h， 以50%的产率得到cholest-5-en-3β-yl 6-isothiocyanatohexyl ether
  参考文献：
  名称：

  Functional cholesteryl binding agents: synthesis, characterization, and evaluation of antibody binding to modified phospholipid vesicles

  摘要：

  A series of functionalized cholesteryl derivatives were synthesized. The various lipophilic protein modification agents were analyzed for their protein binding ability. The binding of human IgG, labeled with 125I, to modified phospholipid vesicles was ascertained. Two agents performed well. These were cholest-5-en-3 beta-yl 5-carboxypentyl ether succinimido ester and cholest-5-en-3 beta-yl 6-carboxyhexyl ether succinimido ester.

  DOI：

  10.1021/jm00160a004