(10alpha,24S)-20,24-环氧-3,25-二羟基-9beta-甲基-19-去甲羊毛甾-5-烯-11-酮 | 7067-16-5

• 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
• 中文名称: (10alpha,24S)-20,24-环氧-3,25-二羟基-9beta-甲基-19-去甲羊毛甾-5-烯-11-酮
• 英文名称: Gratiogenin
• 英文别名: (3S,8S,9R,10R,13R,14S,17S)-3-hydroxy-17-[(2S,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-4,4,9,13,14-pentamethyl-1,2,3,7,8,10,12,15,16,17-decahydrocyclopenta[a]phenanthren-11-one
• CAS: 7067-16-5
• 化学式: C₃₀H₄₈O₄
• 分子量: 472.7
• InChiKey: DJFUSGZOFOKWFY-HVNJZMCDSA-N

物化性质

• 熔点：
  191-196°; mp 202-203°
• 比旋光度：
  D20 +168° (c = 1.193 in chloroform); D20 +151° (c = 0.863 in methanol); D25 +175 ± 3° (chloroform)
• 沸点：
  572.3±50.0 °C(Predicted)
• 密度：
  1.12±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  34
• 可旋转键数：
  2
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.9
• 拓扑面积：
  66.8
• 氢给体数：
  2
• 氢受体数：
  4

文献信息

• USE OF A STEROID FOR ENHANCEMENT OF SKIN PERMEABILITY
  申请人：Novartis AG

  公开号：EP1773336A1

  公开（公告）日：2007-04-18
• Compounds exhibiting efflux inhibitor activity and composition and uses thereof
  申请人：Wempe Fitzpatrick Michael

  公开号：US20070254859A1

  公开（公告）日：2007-11-01

  At least one compound chosen from compounds of Formula I: a pharmaceutically acceptable salt or ester thereof, a solvate thereof, a chelate thereof, a non-covalent complex thereof, a prodrug thereof, and mixtures of any of the foregoing, wherein: n is a number from 1 to 900, wherein the individual units may be the same or different; W is chosen from alkyl, substituted alkyl, cycloalkyl, substituted cycloalkyl, aryl, substituted aryl, aralkyl and substituted aralkyl; each of R 2 , R 3 , R 4 and R 5 is independently chosen from —H, alkyl, substituted alkyl, cycloalkyl, substituted cycloalkyl, aryl, substituted aryl, aralkyl and substituted aralkyl; Z′ is chosen from —O—, —N—, —NO—, —NR 4 —, —S—, —SO— and —SO 2 —, wherein R 4 is defined as above; each of X, X′, Y and Z is independently chosen from —CR 4 R 5 —, —NH—, —NR 4 —, —NO—, —O—, —NOR 4 —, —S—, —SO—, —SO 2 —, wherein R 4 and R 5 are defined as above; R 1 is chosen from a tocopherol, a steroid and a flavonoid; and R 6 is chosen from any R 1 , alkyl, substituted alkyl, cycloalkyl, substituted cycloalkyl, aryl, substituted aryl, aralkyl and substituted aralkyl.
• Use Of A Steroid For Enhancement Of Skin Permeability
  申请人：Meingassner Josef Gottfried

  公开号：US20080171729A1

  公开（公告）日：2008-07-17

  A method for enhancing skin permeability by administration of a tetracyclic compound and improved methods for treatment of disorders by administration of a tetracyclic compound and a pharmaceutically active compound.
• [EN] USE OF A STEROID FOR ENHANCEMENT OF SKIN PERMEABILITY<br/>[FR] UTILISATION D'UN STEROIDE DANS L'AMELIORATION DE LA PERMEABILITE CUTANEE
  申请人：NOVARTIS AG

  公开号：WO2006008092A1

  公开（公告）日：2006-01-26

  A method for enhancing skin permeability by administration of a tetracyclic compound and improved methods for treatment of disorders by administration of a tetracyclic compound and a pharmaceutically active compound.