3β-Hydroxy-17α-methoxy-pregn-5-en-20-on | 86699-12-9

• 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: 3β-Hydroxy-17α-methoxy-pregn-5-en-20-on
• 英文别名: 1-[(3S,10R,13S,17R)-3-hydroxy-17-methoxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]ethanone
• CAS: 86699-12-9；93712-80-2
• 化学式: C₂₂H₃₄O₃
• 分子量: 346.51
• InChiKey: CBWCPYDAGUBJIZ-ALTMMPCJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  25
• 可旋转键数：
  2
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.86
• 拓扑面积：
  46.5
• 氢给体数：
  1
• 氢受体数：
  3

文献信息

• 3-(4'-SUBSTITUTED)-BENZYL-ETHER DERIVATIVES OF PREGNENOLONE
  申请人：INSERM (Institut National de la Santé et de la Recherche Médicale)

  公开号：EP3176176A1

  公开（公告）日：2017-06-07

  The invention relates to a compound of Formula I or a pharmaceutically acceptable salt thereof: wherein R1 is C1-8 alkyl, C1-8 alkoxy, CN, NO2, amino, COOH, COOCH3, OH, N3, or halogen and R2 is H, OH, C1-8 alkyl, C1-8 alkoxy, C2-C6 alkenyl, halogen, Bn-O-, Bn-optionally substituted, or Ph- optionally substituted.

  本发明涉及一种式 I 的化合物或其药学上可接受的盐： 其中R1是C1-8烷基、C1-8烷氧基、CN、NO2、氨基、COOH、COOCH3、OH、N3或卤素，R2是H、OH、C1-8烷基、C1-8烷氧基、C2-C6烯基、卤素、Bn-O-、任选取代的Bn-或任选取代的Ph-。
• ANTAGONISTS OF CB1 RECEPTOR
  申请人：INSERM (Institut National de la Sante et de la Recherche Medicale)

  公开号：US20220153776A1

  公开（公告）日：2022-05-19

  The invention relates to an antagonist of CB1 receptor for use in the treatment of a pathologic condition or disorder selected from the group consisting of bladder and gastrointestinal disorders; inflammatory diseases; cardiovascular diseases; nephropathies; glaucoma; spasticity; cancer; osteoporosis; metabolic disorders; obesity; addiction, dependence, abuse and relapse related disorders; psychiatric and neurological disorders; neurodegenerative disorders; autoimmune hepatitis and encephalitis; pain; reproductive disorders and skin inflammatory and fibrotic diseases.