Butyric acid, 3-methylthio-, S-propyl ester

• 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: Butyric acid, 3-methylthio-, S-propyl ester
• 英文别名: S-propyl 3-methylbutanethioate
• 化学式: C₈H₁₆OS
• 分子量: 160.28
• InChiKey: NZRJNGAJWMNREL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  10
• 可旋转键数：
  5
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  42.4
• 氢给体数：
  0
• 氢受体数：
  2

文献信息

• Aldolase-inhibiting aromatic compounds
  申请人：Dax Chantal

  公开号：US20070043002A1

  公开（公告）日：2007-02-22

  The invention relates to novel aldolase-inhibiting compounds that can be advantageously used as medicaments (in therapeutic doses), especially for treating certain cancers, due to the inhibition efficacy thereof. An inventive compound corresponds to general formula (I) wherein the aldehyde group (—CHO) and the phenol group (—OH) are linked to two carbon atoms adjacent to the same aromatic chain, i.e., the first aromatic chain, and R is a phosphate group or a phosphate group mimetic linked to a carbon atom of the second aromatic chain.
• US7470821B2
  申请人：——

  公开号：US7470821B2

  公开（公告）日：2008-12-30