18-ethyl-3-methoxy-6-oxa-8α-estra-1,3,5(10)-trien-17-one | 1151687-52-3

• 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: 18-ethyl-3-methoxy-6-oxa-8α-estra-1,3,5(10)-trien-17-one
• 英文别名: (3aS,3bS,9bS,11aS)-7-methoxy-11a-propyl-2,3,3a,3b,4,9b,10,11-octahydroindeno[4,5-c]chromen-1-one
• CAS: 1151687-52-3
• 化学式: C₂₀H₂₆O₃
• 分子量: 314.425
• InChiKey: GRHZDZJMEHWJDC-FKKBTLCVSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4
• 重原子数：
  23
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.65
• 拓扑面积：
  35.5
• 氢给体数：
  0
• 氢受体数：
  3

文献信息

• PREPARATION OF 6-OXA-8ALPHA-STEROID ESTROGEN ANALOGUES - A NEW GROUP OF UNNATURAL ESTROGENS AND THEIR USE IN MEDICINE
  申请人：Topass Gmbh

  公开号：EP2225257A2

  公开（公告）日：2010-09-08
• [EN] PREPARATION OF 6-OXA-8ALPHA-STEROID ESTROGEN ANALOGUES - A NEW GROUP OF UNNATURAL ESTROGENS AND THEIR USE IN MEDICINE<br/>[FR] PRÉPARATION D'ANALOGUES DE L'OETROGÈNE 6-OXA-8?-STÉROÏDE - UN NOUVEAU GROUPE D'OETROGÈNES NON NATURELS ET LEUR UTILISATION EN MÉDECINE
  申请人：TOPASS GMBH

  公开号：WO2009059806A2

  公开（公告）日：2009-05-14

  The invention is related to the area of new 6-Oxa-8α-steroid estrogen analogues and the synthesis of these new biological active steroid estrogen analogues, namely, to the preparation of 6-oxa-8α-steroid estrogens and their use as estrogen receptor modulators. These new estrogen analogues are ligands for estrogen receptors and as such may be useful for the treatment and prevention of a variety of conditions related to estrogen functioning. These conditions include bone and cartilage disorders, increased levels of LDL cholesterol, cardiovascular diseases, impairment of cognitive function, cerebral degeneration disorders, endometriosis and other types of inflammation, the metabolic syndrome, and cancer, in particular of the breast, uterus and prostate.