(24S)-1β,3β,24,25-tetrahydroxy-7,9(11)-euphadiene | 1227408-69-6

• 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: (24S)-1β,3β,24,25-tetrahydroxy-7,9(11)-euphadiene
• 英文别名: (1R,3S,5S,10S,13S,14S,17S)-17-[(2R,5S)-5,6-dihydroxy-6-methylheptan-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthrene-1,3-diol
• CAS: 1227408-69-6
• 化学式: C₃₀H₅₀O₄
• 分子量: 474.725
• InChiKey: BEFZFCBQLAOWOK-BVNBUQPCSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.2
• 重原子数：
  34
• 可旋转键数：
  5
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.87
• 拓扑面积：
  80.9
• 氢给体数：
  4
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  (24S)-1β,3β,24,25-tetrahydroxy-7,9(11)-euphadiene 、 (S)-(+)-alpha-甲氧基苯乙酸 在 4-二甲氨基吡啶 、 盐酸-N-乙基-Nˊ-(3-二甲氨基丙基)碳二亚胺 作用下， 以 二氯甲烷 为溶剂， 反应 36.0h， 以0.5 mg的产率得到
  参考文献：
  名称：

  Euphane triterpenoids of Cassipourea lanceolata from the Madagascar rainforest

  摘要：

  Fractionation of an ethanol extract of a Madagascar collection of the leaves and fruit of Cassipourea lanceolata Tul. led to the isolation of three euphane triterpenoids 1-3. The (1)H and (13)C NMR spectra of all compounds were fully assigned using a combination of 2D NMR experiments, including COSY, TOCSY, HSQC (HMQC), HMBC and ROESY sequences. The three compounds showed weak antiproliferative activities against the A2780 human ovarian cancer cell line, with IC(50) values of 25, 25 and 32 mu M, respectively. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.phytochem.2009.12.009

文献信息

• Euphane triterpenoids of Cassipourea lanceolata from the Madagascar rainforest
  作者：Yanpeng Hou、Shugeng Cao、Peggy J. Brodie、James S. Miller、Chris Birkinshaw、Mamisoa N. Andrianjafy、Rabodo Andriantsiferana、Vincent E. Rasamison、Karen TenDyke、Yongchun Shen、Edward M. Suh、David G.I. Kingston

  DOI：10.1016/j.phytochem.2009.12.009

  日期：2010.4

  Fractionation of an ethanol extract of a Madagascar collection of the leaves and fruit of Cassipourea lanceolata Tul. led to the isolation of three euphane triterpenoids 1-3. The (1)H and (13)C NMR spectra of all compounds were fully assigned using a combination of 2D NMR experiments, including COSY, TOCSY, HSQC (HMQC), HMBC and ROESY sequences. The three compounds showed weak antiproliferative activities against the A2780 human ovarian cancer cell line, with IC(50) values of 25, 25 and 32 mu M, respectively. (C) 2009 Elsevier Ltd. All rights reserved.