(12Z,15Z)-1-(tert-Butyl-diphenyl-silanyloxy)-henicosa-12,15-dien-4-one | 577973-82-1

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: (12Z,15Z)-1-(tert-Butyl-diphenyl-silanyloxy)-henicosa-12,15-dien-4-one
• CAS: 577973-82-1
• 化学式: C₃₇H₅₆O₂Si
• 分子量: 560.936
• InChiKey: XLIBKFQJBSVPBP-UTJQPWESSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.73
• 重原子数：
  40.0
• 可旋转键数：
  21.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  26.3
• 氢给体数：
  0.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  (12Z,15Z)-1-(tert-Butyl-diphenyl-silanyloxy)-henicosa-12,15-dien-4-one 在 四丁基氟化铵 作用下， 以 四氢呋喃 为溶剂， 以94%的产率得到(12Z,15Z)-1-Hydroxy-henicosa-12,15-dien-4-one
  参考文献：
  名称：

  Hemisynthesis and preliminary evaluation of novel endocannabinoid analogues

  摘要：

  Three new endocannabinoid analogues in which amide moiety was replaced either by oxomethylene group or ester moiety with simultaneous substitution of both alpha-hydrogens with methyl groups were synthesized and their abilities to interact with CB1-receptor and FAAH were investigated. (C) 2003 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(03)00348-2
• 作为产物：
  描述：

  叔丁基二苯基氯硅烷 在 锌铜偶 、 sodium iodide 作用下， 以 二氯甲烷 、 N,N-二甲基乙酰胺 、 丙酮 、 苯 为溶剂， 生成 (12Z,15Z)-1-(tert-Butyl-diphenyl-silanyloxy)-henicosa-12,15-dien-4-one
  参考文献：
  名称：

  Hemisynthesis and preliminary evaluation of novel endocannabinoid analogues

  摘要：

  Three new endocannabinoid analogues in which amide moiety was replaced either by oxomethylene group or ester moiety with simultaneous substitution of both alpha-hydrogens with methyl groups were synthesized and their abilities to interact with CB1-receptor and FAAH were investigated. (C) 2003 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(03)00348-2