No-ursodeoxycholic acid | 401519-96-8

• 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: No-ursodeoxycholic acid
• 英文别名: [2-methoxy-4-[(E)-3-(4-nitrooxybutoxy)-3-oxoprop-1-enyl]phenyl] (4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate
• CAS: 401519-96-8
• 化学式: C38H55NO10
• 分子量: 685.8
• InChiKey: WTAVOESJEWSDJC-OBOLPPCUSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8
• 重原子数：
  49
• 可旋转键数：
  15
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.74
• 拓扑面积：
  157
• 氢给体数：
  2
• 氢受体数：
  10

文献信息

• Deoxycholic acid derivatives for the treatment of acute dysfunctions of portal and hepatic venous circulation
  申请人：Del Soldato Piero

  公开号：US20060094664A1

  公开（公告）日：2006-05-04

  Use of compounds and their salts of formula (I), as reported in the description, in the preparation of drugs for the treatment of acute dysfunctions of portal and hepatic venous circulation.