胆烷-24-醇,(5b)- | 85197-76-8

• 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: 胆烷-24-醇,(5b)-
• 英文名称: 17-epi-Tipredane
• 英文别名: (8S,10S,11S,13S,14S,17R)-17-ethylsulfanyl-9-fluoro-11-hydroxy-10,13-dimethyl-17-methylsulfanyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
• CAS: 85197-76-8
• 化学式: C₂₂H₃₁FO₂S₂
• 分子量: 410.6
• InChiKey: DXEXNWDGDYUITL-IBOYTWHMSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  27
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.77
• 拓扑面积：
  87.9
• 氢给体数：
  1
• 氢受体数：
  5

文献信息

• Selective thioketalization process, process for preparing thioenol ethers from thioketals, and process for the preparation of thioketals
  申请人：E.R. SQUIBB & SONS, INC.

  公开号：EP0524813A1

  公开（公告）日：1993-01-27

  A selective thioketalization process for the preparation of a thioketal from a dione where one, but not the other, keto group of the dione is α,β-unsaturated, and where selective thioketalization occurs at the keto group of the dione which is not α,β-unsaturated, comprising the step of contacting the dione with a thiol, in the presence of a protic acid catalyst which is a complex of a Lewis acid and a protic source, wherein the temperature of the reaction medium is maintained below about 25°C during the reaction. Preferably, further, (i) the acid catalyst is employed in excess and/or (ii) the thiol is employed in excess. The inventive process may be employed, for example, in the preparation of a 3-keto,17-thioketalandrostene from the corresponding 3,17-diketoandrostene. A process for the preparation of thioenolethers from thioketals, especially 3-keto,17-thioenoletherandrostenes from 3-keto,17-thioketalandrostenes, wherein the thioketal is contacted with a protic acid catalyst. A process for the preparation of thioketals, especially mixed thioketals such as mixed 3-keto,17-thioketalandrostenes, from thioenolethers, comprising the step of contacting a thioenolether with a thiol in the presence of a protic acid catalyst.

  一种选择性硫醚化过程，用于从二酮制备硫醚，其中二酮的一个但不是另一个酮基是α，β-不饱和的，选择性硫醚化发生在不是α，β-不饱和的酮基上，包括将二酮与硫醇接触，在存在Lewis酸和质子源的复合物的质子酸催化剂的情况下，反应介质的温度在反应过程中保持在大约25°C以下。最好，进一步，(i) 过量使用酸催化剂和/或 (ii) 过量使用硫醇。该创新过程可以用于从相应的3,17-二酮雄烯制备3-酮，17-硫醚雄烯。一种从硫醚制备硫烯醚的过程，特别是从3-酮，17-硫醚雄烯制备3-酮，17-硫烯醚雄烯的过程，其中硫醚与质子酸催化剂接触。一种从硫烯醚制备硫醚的过程，特别是从硫烯醚制备混合硫醚，例如混合的3-酮，17-硫醚雄烯，包括将硫烯醚与硫醇在质子酸催化剂的存在下接触的步骤。
• 17,17-Bis(substituted thio)-3-ketoandrostenes and pharmaceutical compositions
  申请人：E.R. Squibb & Sons, Inc.

  公开号：EP0073026A1

  公开（公告）日：1983-03-02

  Described are 3-Ketoandrostenes having in the 17- position the substituents R,-S- and R2-S- wherein R, and R2 are the same or different and each is alkyl, cycloalkyl or aryl, which have antiinflammatory activity.

  所述的 3-酮雄烯在 17- 位具有取代基 R、-S- 和 R2-S-，其中 R 和 R2 相同或不同，且各自为烷基、环烷基或芳基，具有抗炎活性。
• US4361559A
  申请人：——

  公开号：US4361559A

  公开（公告）日：1982-11-30