(-)-(1S,2S,6S)-1,3,3-trimethylbicyclo[2.2.1]heptan-2,6-diacetate | 689277-94-9

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: (-)-(1S,2S,6S)-1,3,3-trimethylbicyclo[2.2.1]heptan-2,6-diacetate
• 英文别名: (1S,2S,6S)-2,6-diacetoxyfenchol；Diacetat des 2-exo-6-endo-Dihydrxy-fenchans; 3d
• CAS: 689277-94-9
• 化学式: C₁₄H₂₂O₄
• 分子量: 254.326
• InChiKey: XMYFYDGDKSDLGV-MNXVOIDGSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.31
• 重原子数：
  18.0
• 可旋转键数：
  2.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.86
• 拓扑面积：
  52.6
• 氢给体数：
  0.0
• 氢受体数：
  4.0

反应信息

• 作为产物：
  描述：

  小茴香醇 在 吡啶 、 Spodoptera litura 作用下， 反应 101.0h， 生成 (-)-(1S,2S,6S)-1,3,3-trimethylbicyclo[2.2.1]heptan-2,6-diacetate
  参考文献：
  名称：

  Biotransformation of (+)-(1R,2S)-fenchol by the larvae of common cutworm (Spodoptera litura)

  摘要：

  Biotransformation of (+)-(1R,2S)-fenchol by the larvae of Spodoptera litura was carried out. Substrate was converted to three new terpenoids, (+)-(1R,2S)-10-hydroxyfenchol, (+)-(1R,2R,3S)-8-hydroxyfenchol and (-)-(1S,2S,6S)-6-exo-hydroxyfenchol, and one known terpenoid, (-)-(1R,2R,3R)-9-hydroxyfenchol. These structures were established by NMR, IR, specific rotation and mass spectral studies. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2004.01.076