celosin B | 915138-26-0

• 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: celosin B
• 英文别名: 2-hydroxy-23-carboxy-3-O-[β-D-galactopyranosyl-(1->2)-β-D-glucuronopyranosyl]oleanolic acid
• CAS: 915138-26-0
• 化学式: C₄₂H₆₄O₁₇
• 分子量: 840.96
• InChiKey: QUHNEZSEVDIAOV-AMXVFUMESA-N

物化性质

• 沸点：
  999.9±65.0 °C(Predicted)
• 密度：
  1.47±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.01
• 重原子数：
  59.0
• 可旋转键数：
  8.0
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  290.43
• 氢给体数：
  10.0
• 氢受体数：
  14.0

反应信息

• 作为反应物：
  描述：

  celosin B 在 水 作用下， 生成 口服葡萄糖 、 D-葡萄糖醛酸 、 苜蓿酸
  参考文献：
  名称：

  Two new compounds fromSemen celosiaeand their protective effects against CCl₄-induced hepatotoxicity

  摘要：

  Two new oleanolic acid saponins, namely celosin A (1) and celosin B (2), together with six known compounds, stigmasterol (3), -sitosterol (4), -daucosterol (5), hexacosoic acid (6), palmitic acid (7) and stearic acid (8), were isolated from the ethanolic extract of Semen celosiae. The structures of celosin A (1) and celosin B (2) were determined by spectral analysis (including 1D- and 2D-NMR). The hepatoprotective activity of 1 and 2 with oral doses 1.0, 2.0 and 4.0 mg kg-1 were investigated by carbon tetrachloride (CCl4)-induced hepatotoxicity in mice. The results indicate that they have significant hepatoprotective effects, and that these hepatoprotective effects may be due to the antioxidant capability.

  DOI：

  10.1080/14786410902833948

文献信息

• Two new compounds from<i>Semen celosiae</i>and their protective effects against CCl₄-induced hepatotoxicity
  作者：Qian Xue、Zhen-Liang Sun、Mei-Li Guo、Ying Wang、Ge Zhang、Xiao-Kang Wang

  DOI：10.1080/14786410902833948

  日期：2011.4

  Two new oleanolic acid saponins, namely celosin A (1) and celosin B (2), together with six known compounds, stigmasterol (3), -sitosterol (4), -daucosterol (5), hexacosoic acid (6), palmitic acid (7) and stearic acid (8), were isolated from the ethanolic extract of Semen celosiae. The structures of celosin A (1) and celosin B (2) were determined by spectral analysis (including 1D- and 2D-NMR). The hepatoprotective activity of 1 and 2 with oral doses 1.0, 2.0 and 4.0 mg kg-1 were investigated by carbon tetrachloride (CCl4)-induced hepatotoxicity in mice. The results indicate that they have significant hepatoprotective effects, and that these hepatoprotective effects may be due to the antioxidant capability.