(4R)-4-[(8R,9S,10S,13R,17R)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid

• 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: (4R)-4-[(8R,9S,10S,13R,17R)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
• 化学式: C₂₄H₄₀O₂
• 分子量: 360.6
• InChiKey: RPKLZQLYODPWTM-CJBGRYJPSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8
• 重原子数：
  26
• 可旋转键数：
  4
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.96
• 拓扑面积：
  37.3
• 氢给体数：
  1
• 氢受体数：
  2

文献信息

• [EN] IDENTIFICATION OF CLOSTRIDIUM DIFFICILE CSPC AS A BILE ACID GERMINANT RECEPTOR<br/>[FR] IDENTIFICATION DE CLOSTRIDIUM DIFFICILE CSPC COMME RÉCEPTEUR DE GERMINATION DE L'ACIDE BILIAIRE
  申请人：SORG JOSEPH A

  公开号：WO2014143033A1

  公开（公告）日：2014-09-18

  The invention provides, inter alia, method of identifying a test compound that binds a germination-related protease-like protein (CspC), e.g., compounds that are agonists or antagonists of germination of a spore of a Clostridium species, such as Clostridium difficile. The invention also provides methods of treating and/or preventing a Clostridium infection in a mammalian subject in need thereof.