(5R,8Z,11Z)-5-β-D-glucopyranosyloxy-6-oxotetradeca-8,11-dienoic acid | 1236361-19-5

• 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: (5R,8Z,11Z)-5-β-D-glucopyranosyloxy-6-oxotetradeca-8,11-dienoic acid
• 英文别名: (5R,8Z,11Z)-6-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytetradeca-8,11-dienoic acid
• CAS: 1236361-19-5
• 化学式: C₂₀H₃₂O₉
• 分子量: 416.469
• InChiKey: KNKZVVULPDJUHA-INIYILFCSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.3
• 重原子数：
  29
• 可旋转键数：
  13
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  154
• 氢给体数：
  5
• 氢受体数：
  9

反应信息

• 作为反应物：
  描述：

  (5R,8Z,11Z)-5-β-D-glucopyranosyloxy-6-oxotetradeca-8,11-dienoic acid 、 乙酸酐 在 吡啶 作用下， 反应 4.0h， 以3 mg的产率得到
  参考文献：
  名称：

  C14-Oxylipin glucosides isolated from Lemna paucicostata

  摘要：

  Oxylipin glucosides (2-4) were isolated from Lemna paucicostata with their structures and absolute configurations elucidated by spectroscopic and chemical methods. Compounds 2-4 were glucosides of C-14 oxylipin which were synthesized from alpha-linolenic acid via the 9-lipoxygenase pathway. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.phytochem.2010.04.015