arabidopside C | 852369-54-1

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 甘油脂
• 英文名称: arabidopside C
• 英文别名: Arabidopside C；[(2S)-2-[6-[4-oxo-5-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl]hexanoyloxy]-3-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxypropyl] 8-[4-oxo-5-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl]octanoate
• CAS: 852369-54-1
• 化学式: C₄₉H₇₆O₁₇
• 分子量: 937.132
• InChiKey: GXTGTCSHGJLVPW-GUDILZOUSA-N

物化性质

• 沸点：
  1025.227±65.00 °C(Press: 760.00 Torr)(predicted)
• 密度：
  1.278±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  66
• 可旋转键数：
  32
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.76
• 拓扑面积：
  265
• 氢给体数：
  7
• 氢受体数：
  17

反应信息

• 作为反应物：
  描述：

  arabidopside C 在 Lipase type XI 、 Triton X-100 作用下， 以 various solvent(s) 为溶剂， 反应 12.0h， 以62%的产率得到4-<7-carboxyheptyl(1)>-5-pent-2-en-yl(1)-cyclopent-2-en-1-one
  参考文献：
  名称：

  Oxylipins Arabidopsides C and D from Arabidopsis thaliana

  摘要：

  Two new oxylipins, arabidopsides C (1) and D (2), were isolated from the aerial parts of Arabidopsis thaliana, and the structures of 1 and 2 were elucidated using spectroscopic data, primarily NMR and MS, and chemical means. Arabidopsides C (1) and D (2) are rare digalactosyl diacylglycerides containing 12-oxophytodienoic acid and/or dinor-oxophytodienoic acid. Arabidopside D (2) and arabidopsides A (3) and B (4), which were also isolated from this plant, exhibited inhibitory effects on the growth of the root of cress (Lepidium sativum) seedlings at 5 x 10(-5) mol/L.

  DOI：

  10.1021/np0495938

文献信息

• Oxylipins Arabidopsides C and D from <i>Arabidopsis </i><i>t</i><i>haliana</i>
  作者：Yosuke Hisamatsu、Nobuharu Goto、Mitsuhiro Sekiguchi、Koji Hasegawa、Hideyuki Shigemori

  DOI：10.1021/np0495938

  日期：2005.4.1

  Two new oxylipins, arabidopsides C (1) and D (2), were isolated from the aerial parts of Arabidopsis thaliana, and the structures of 1 and 2 were elucidated using spectroscopic data, primarily NMR and MS, and chemical means. Arabidopsides C (1) and D (2) are rare digalactosyl diacylglycerides containing 12-oxophytodienoic acid and/or dinor-oxophytodienoic acid. Arabidopside D (2) and arabidopsides A (3) and B (4), which were also isolated from this plant, exhibited inhibitory effects on the growth of the root of cress (Lepidium sativum) seedlings at 5 x 10(-5) mol/L.