(7alpha,14beta,17alpha)-17-Hydroxy-7-methylestr-4-en-3-one | 436144-66-0

• 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: (7alpha,14beta,17alpha)-17-Hydroxy-7-methylestr-4-en-3-one
• 英文别名: (7α,14β,17α)-17-hydroxy-7-methylestr-4-en-3-one；(7R,8R,9S,10R,13S,14R,17R)-17-hydroxy-7,13-dimethyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one
• CAS: 436144-66-0
• 化学式: C₁₉H₂₈O₂
• 分子量: 288.43
• InChiKey: YSGQGNQWBLYHPE-IFZMVTOXSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  21
• 可旋转键数：
  0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.84
• 拓扑面积：
  37.3
• 氢给体数：
  1
• 氢受体数：
  2

文献信息

• 17Alpha-hydroxy-14Beta-steroids with hormonal effect
  申请人：——

  公开号：US20040259849A1

  公开（公告）日：2004-12-23

  This invention relates to steroidal compounds having the formula (I), wherein: R 1 is O, (H,H), (H,OH), NOH, whereby OH is optionally etherified or esterified; R 2 and R 3 are independently hydrogen or (C 1-4 ) alkyl and at least one of R 2 and R 3 is (C 1-4 ) alkyl; R 4 is hydrogen, or (C 1-15 ) acyl for use in androgen-related treatments, such as androgen insufficiency and male or female contraception.

  本发明涉及具有式（I）的类固醇化合物，其中：R1为O，（H，H），（H，OH），NOH，其中OH可以选择性地醚化或酯化；R2和R3独立地为氢或（C1-4）烷基，并且R2和R3中至少有一个为（C1-4）烷基；R4为氢或（C1-15）酰基，用于与雄激素相关的治疗，例如雄激素不足和男性或女性避孕。
• 14 Beta, 16, 17-methylene steroids as novel androgens
  申请人：——

  公开号：US20040030165A1

  公开（公告）日：2004-02-12

  Disclosed are androgenic steroids of the (14&bgr;,17&agr;)-17-(hydroxymethyl) type. The invention relates to an improvement hereof, which is based on the presence of a &x3B2;-oriented, annellated cyclopropyl group which includes carbon atoms 16 and 17 of the steroid skeleton, i.e. a 16,17&bgr;-methylene moiety. These steroids show an unexpectedly high androgenic potency.

  本发明公开了(14&bgr;,17&agr;)-17-(羟甲基)型雄激素类固醇。本发明涉及对这种类固醇的改进，改进的基础是存在一个&x3B2;取向的环丙基，环丙基包括类固醇骨架的碳原子 16 和 17，即一个 16,17&bgr;-亚甲基。这些类固醇具有意想不到的高雄激素效力。
• METHYLENE STEROIDS AS NOVEL ANDROGENS
  申请人：N.V. Organon

  公开号：EP1343806B1

  公开（公告）日：2008-05-28
• 17ALPHA-HYDROXY-14BETA-STEROIDS WITH HORMONAL EFFECT
  申请人：N.V. Organon

  公开号：EP1427748B1

  公开（公告）日：2008-05-14
• US6949531B2
  申请人：——

  公开号：US6949531B2

  公开（公告）日：2005-09-27