(3S,5R,6'S,8R)-5-(6'-hydroxyheptyl)-3-methylpyrrolizidine | 1166863-91-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯里西啶类
• 英文名称: (3S,5R,6'S,8R)-5-(6'-hydroxyheptyl)-3-methylpyrrolizidine
• 英文别名: (S)-7-((3R,5S,7aR)-5-Methyl-hexahydro-pyrrolizin-3-yl)-heptan-2-ol；(2S)-7-[(3R,5S,8R)-5-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-3-yl]heptan-2-ol
• CAS: 1166863-91-7
• 化学式: C₁₅H₂₉NO
• 分子量: 239.401
• InChiKey: MZVMQPFTTQKLEJ-BYNSBNAKSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  17
• 可旋转键数：
  6
• 环数：
  2.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  23.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  [(2R)-2-hydroxy-7-[(3R,5S,8R)-5-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-3-yl]heptyl] 4-methylbenzenesulfonate 在 三乙基硼氢化锂 作用下， 以 四氢呋喃 为溶剂， 反应 5.0h， 生成 (3S,5R,6'S,8R)-5-(6'-hydroxyheptyl)-3-methylpyrrolizidine
  参考文献：
  名称：

  Catalytic Asymmetric Synthesis of Both Enantiomers of Pyrrolizidines 223H’, 239K’, 265H’, and 267H’ Found in Madagascan Frogs (Mantella) and Their Affinities for Nicotinic Acetylcholine Receptor

  摘要：

  The asymmetric synthesis of pyrrolizidines 223H', 239K', 265H', and 267H' has been achieved starting from 1,5-hexadiene via a common synthetic intermediate 5. The affinity of both enanthiomers of 1-4 for nicotinic acetylcholine receptor was evaluated.

  DOI：

  10.3987/com-08-s(d)81

文献信息

• Catalytic Asymmetric Synthesis of Both Enantiomers of Pyrrolizidines 223H’, 239K’, 265H’, and 267H’ Found in Madagascan Frogs (Mantella) and Their Affinities for Nicotinic Acetylcholine Receptor
  作者：Hiroki Takahata、Yukako Saito、Seiki Takahashi、Nehad Azer、Amira T. Eldefrawi、Mohyee E. Eldefrawi

  DOI：10.3987/com-08-s(d)81

  日期：——

  The asymmetric synthesis of pyrrolizidines 223H', 239K', 265H', and 267H' has been achieved starting from 1,5-hexadiene via a common synthetic intermediate 5. The affinity of both enanthiomers of 1-4 for nicotinic acetylcholine receptor was evaluated.