4-acetyl-bergenin

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 类固醇和类固醇衍生物
• 英文名称: 4-acetyl-bergenin
• 化学式: C₁₆H₁₈O₁₀
• 分子量: 370.313
• InChiKey: GFVQCVUHVKDQDK-CNSIFVFBSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.63
• 重原子数：
  26.0
• 可旋转键数：
  3.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  151.98
• 氢给体数：
  4.0
• 氢受体数：
  10.0

反应信息

• 作为产物：
  描述：

  岩白菜素 在 lipase mixture 、 potassium chloride 、 subtilisin 作用下， 以 水 、 二甲基亚砜 、 甲苯 、 乙腈 为溶剂， 反应 288.0h， 生成 4-acetyl-bergenin
  参考文献：
  名称：

  Biocatalytic combinatorial synthesis

  摘要：

  Combinatorial biocatalysis, based on a principle of the combinatorial use of biosynthetic steps rather than the combinatorial use of reagents, offers a complementary approach to combinatorial chemistry, which, used individually or in connection with synthetic organic transformations, provides access to analogues not readily accessible by chemical synthetic means alone. The issues and strategies particular to this approach are discussed. Examples are given demonstrating these principles as well as the unique advantages of achieving chemo-, regio- and stereoselectivity under mild reaction conditions that biocatalytic methods offer. (C) 1999 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0968-0896(99)00145-5

文献信息

• Biocatalytic combinatorial synthesis
  作者：John L. Krstenansky、Yuri Khmelnitsky

  DOI：10.1016/s0968-0896(99)00145-5

  日期：1999.10

  Combinatorial biocatalysis, based on a principle of the combinatorial use of biosynthetic steps rather than the combinatorial use of reagents, offers a complementary approach to combinatorial chemistry, which, used individually or in connection with synthetic organic transformations, provides access to analogues not readily accessible by chemical synthetic means alone. The issues and strategies particular to this approach are discussed. Examples are given demonstrating these principles as well as the unique advantages of achieving chemo-, regio- and stereoselectivity under mild reaction conditions that biocatalytic methods offer. (C) 1999 Elsevier Science Ltd. All rights reserved.