Acetic acid (6S,8R,9S,10R,13S,14S,17R)-17-acetyl-6,10,13-trimethyl-16-methylene-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl ester | 4008-83-7

• 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: Acetic acid (6S,8R,9S,10R,13S,14S,17R)-17-acetyl-6,10,13-trimethyl-16-methylene-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl ester
• 英文别名: Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate；[(6S,8R,9S,10R,13S,14S,17R)-17-acetyl-6,10,13-trimethyl-16-methylidene-3-oxo-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-17-yl] acetate
• CAS: 4008-83-7
• 化学式: C₂₅H₃₄O₄
• 分子量: 398.543
• InChiKey: UHELYGIJWKJWLN-UZEUMTRXSA-N

物化性质

• 熔点：
  203-207 °C(Solv: water (7732-18-5); methanol (67-56-1))
• 沸点：
  505.6±50.0 °C(Predicted)
• 密度：
  1.13±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  29
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.72
• 拓扑面积：
  60.4
• 氢给体数：
  0
• 氢受体数：
  4

文献信息

• 16-Sulfinylmethyl-steroids, their preparation and use
  申请人：THE UPJOHN COMPANY

  公开号：EP0179496A1

  公开（公告）日：1986-04-30

  Novel 16-sulfinylmethyl-steroids are prepared by reaction of the corresponding 16-methylene-17β-hydroxy-steroid with a sulfenylating agent, and are converted to corresponding 16-methylene-17a-hydroxy-progesterones by reaction with a thiophile. 17a-Hydroxy-6,16-dimethylene-pregn-4- ene-3,20-dione is simultaneously isomerised and acylated to give melengestrol acetate.

  通过相应的 16-亚甲基-17β-羟基类固醇与亚磺酰化剂反应，制备新型 16-亚磺酰甲基类固醇，并通过与亲硫剂反应转化为相应的 16-亚甲基-17a-羟基孕酮。
• Combination Therapies using Melengestrol Acetate and Zilpaterol or its Salts
  申请人：Wray Mary Irene

  公开号：US20090181906A1

  公开（公告）日：2009-07-16

  This invention generally relates to a method for promoting growth and increasing feed utilization efficiency in animals, and, more specifically, to combinations comprising zilpaterol (and salts thereof) and melengestrol acetate. Included within this invention are treatment methods comprising the administration of such combinations to animals, compositions comprising such combinations, uses of such combinations to prepare medicaments, and kits for using such combinations.
• US4443377A
  申请人：——

  公开号：US4443377A

  公开（公告）日：1984-04-17
• US8580772B2
  申请人：——

  公开号：US8580772B2

  公开（公告）日：2013-11-12