6β-((2'S)-2-methylbutyryloxy)furanoeremophilan-10β-ol | 1028530-08-6

• 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: 6β-((2'S)-2-methylbutyryloxy)furanoeremophilan-10β-ol
• 英文别名: [(4S,4aS,5S,8aS)-8a-hydroxy-3,4a,5-trimethyl-4,5,6,7,8,9-hexahydrobenzo[f][1]benzofuran-4-yl] (2S)-2-methylbutanoate
• CAS: 1028530-08-6
• 化学式: C₂₀H₃₀O₄
• 分子量: 334.456
• InChiKey: ZGSGPGJJWNVAIA-GELZBODSSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.2
• 重原子数：
  24
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  59.7
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  furanoeremophilane-6β,10β-diol 、 (S)-(+)-2-甲基丁酸酐 在 4-二甲氨基吡啶 作用下， 以 吡啶 为溶剂， 反应 48.0h， 以2.8 mg的产率得到6β-((2'S)-2-methylbutyryloxy)furanoeremophilan-10β-ol
  参考文献：
  名称：

  Diversity of Ligularia kanaitzensis in sesquiterpenoid composition and neutral DNA sequences

  摘要：

  Twenty-six eremophilane-type sesquiterpenoids, including six new compounds, were isolated from the title species. One of the new compounds, kanaitzensol, suggested the presence of an enzyme for the conversion of eremophil-7(11)-en-8-one derivative to furanoeremophilanes. The plant was collected at 15 locations in Yunnan Province of China and found to be diverse with respect to its sesquiterpenoid composition. DNA sequencing also revealed a large intraspecific diversity of the plant. (c) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2008.02.036

文献信息

• Diversity of Ligularia kanaitzensis in sesquiterpenoid composition and neutral DNA sequences
  作者：Motoo Tori、Aki Watanabe、Sachie Matsuo、Yasuko Okamoto、Kana Tachikawa、Shigeru Takaoka、Xun Gong、Chiaki Kuroda、Ryo Hanai

  DOI：10.1016/j.tet.2008.02.036

  日期：2008.5

  Twenty-six eremophilane-type sesquiterpenoids, including six new compounds, were isolated from the title species. One of the new compounds, kanaitzensol, suggested the presence of an enzyme for the conversion of eremophil-7(11)-en-8-one derivative to furanoeremophilanes. The plant was collected at 15 locations in Yunnan Province of China and found to be diverse with respect to its sesquiterpenoid composition. DNA sequencing also revealed a large intraspecific diversity of the plant. (c) 2008 Elsevier Ltd. All rights reserved.