aleuritolonic acid | 28937-86-2

• 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: aleuritolonic acid
• 英文别名: (4aS,6aR,6bR,8aR,12aR,14aS,14bS)-2,2,6b,9,9,12a,14a-heptamethyl-10-oxo-3,4,5,6a,7,8,8a,11,12,13,14,14b-dodecahydro-1H-picene-4a-carboxylic acid
• CAS: 28937-86-2
• 化学式: C₃₀H₄₆O₃
• 分子量: 454.693
• InChiKey: RJPTYANCUZSYFG-LERFIFKESA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.5
• 重原子数：
  33
• 可旋转键数：
  1
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.87
• 拓扑面积：
  54.4
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  3α-hydroxytaraxer-14-en-28-oic acid 在 pyridinium chlorochromate 作用下， 以 二氯甲烷 、 丙酮 为溶剂， 以88%的产率得到aleuritolonic acid
  参考文献：
  名称：

  Anti-HIV and NO production inhibition activities of epi-aleuritolic acid derivatives

  摘要：

  Fifteen epi-aleuritolic acid derivatives were synthesized and evaluated for anti-HIV activity in 293 T cells and NO production inhibition activity. Of the derivatives, 1, 2, 3, 4, 11, and 13 showed relatively potent anti-HIV activity with EC50 values ranging from 5.80 to 13.30M. The most potent compound, 3-2,2-dimethylsuccinic acyl epi-aleuritolic acid (11), displayed significant anti-HIV activity with an EC50 value of 5.80M. Compounds 1, 3, 4, and 11 showed NO inhibition activity, with IC50 values ranging from 3.40 to 7.10M and compound 1 inhibited NO production with an IC50 value of 3.40M.

  DOI：

  10.1080/10286020.2013.787990

文献信息

• Anti-HIV and NO production inhibition activities of epi-aleuritolic acid derivatives
  作者：Jia-Bao Liu、Ying Zhang、Bao-Song Cui、Ying-Li Cao、Shao-Peng Yuan、Ying Guo、Qi Hou、Shuai Li

  DOI：10.1080/10286020.2013.787990

  日期：2013.5

  Fifteen epi-aleuritolic acid derivatives were synthesized and evaluated for anti-HIV activity in 293 T cells and NO production inhibition activity. Of the derivatives, 1, 2, 3, 4, 11, and 13 showed relatively potent anti-HIV activity with EC50 values ranging from 5.80 to 13.30M. The most potent compound, 3-2,2-dimethylsuccinic acyl epi-aleuritolic acid (11), displayed significant anti-HIV activity with an EC50 value of 5.80M. Compounds 1, 3, 4, and 11 showed NO inhibition activity, with IC50 values ranging from 3.40 to 7.10M and compound 1 inhibited NO production with an IC50 value of 3.40M.