| 358740-16-6

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• CAS: 358740-16-6
• 化学式: C₁₉H₃₆O
• 分子量: 280.494
• InChiKey: GCTCZEKTXCOAQS-KHPPLWFESA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.47
• 重原子数：
  20.0
• 可旋转键数：
  15.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.84
• 拓扑面积：
  17.07
• 氢给体数：
  0.0
• 氢受体数：
  1.0

反应信息

• 作为反应物：
  描述：

  在 乙醇 、 水 、 戴斯-马丁氧化剂 、 乙酰氯 作用下， 以 四氢呋喃 、 二氯甲烷 、 氯仿 为溶剂， 反应 90.0h， 生成 (Z)-2-Methyl-1-oxazolo[4,5-b]pyridin-2-yl-octadec-9-en-1-one
  参考文献：
  名称：

  α-Keto heterocycle inhibitors of fatty acid amide hydrolase: carbonyl group modification and α-substitution

  摘要：

  Two sets of novel analogues of the recently disclosed alpha -keto heterocycle inhibitors of fatty acid amide hydrolase (FAAH), the enzyme responsible for regulation of endogenous oleamide and anandamide, were synthesized and evaluated in order to clarify a role of the electrophilic carbonyl group and structural features important for their activity. Both the electrophilic carbonyl and the degree of alpha -substitution markedly affect inhibitor potency. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(01)00211-6
• 作为产物：
  描述：

  (Z)-2-Methyl-octadec-9-en-1-ol 在 戴斯-马丁氧化剂 作用下， 以 二氯甲烷 为溶剂， 反应 3.0h， 以87%的产率得到
  参考文献：
  名称：

  α-Keto heterocycle inhibitors of fatty acid amide hydrolase: carbonyl group modification and α-substitution

  摘要：

  Two sets of novel analogues of the recently disclosed alpha -keto heterocycle inhibitors of fatty acid amide hydrolase (FAAH), the enzyme responsible for regulation of endogenous oleamide and anandamide, were synthesized and evaluated in order to clarify a role of the electrophilic carbonyl group and structural features important for their activity. Both the electrophilic carbonyl and the degree of alpha -substitution markedly affect inhibitor potency. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(01)00211-6