(1S,5S,7aS)-1-[tert-butyl(dimethyl)silyl]oxy-7a-methyl-4-pent-4-enyl-1,2,3,5,6,7-hexahydroinden-5-ol | 1418284-65-7

• 分子结构分类: 有机化合物 - 有机金属化合物 - 有机类金属化合物
• 英文名称: (1S,5S,7aS)-1-[tert-butyl(dimethyl)silyl]oxy-7a-methyl-4-pent-4-enyl-1,2,3,5,6,7-hexahydroinden-5-ol
• CAS: 1418284-65-7
• 化学式: C₂₁H₃₈O₂Si
• 分子量: 350.617
• InChiKey: MNJOQNDVKJXSBF-ZJOUEHCJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.98
• 重原子数：
  24
• 可旋转键数：
  7
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.81
• 拓扑面积：
  29.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  (1S,5S,7aS)-1-[tert-butyl(dimethyl)silyl]oxy-7a-methyl-4-pent-4-enyl-1,2,3,5,6,7-hexahydroinden-5-ol 在 间氯过氧苯甲酸 作用下， 以 二氯甲烷 为溶剂， 反应 3.0h， 以85%的产率得到
  参考文献：
  名称：

  A concise, enantiospecific, Hajos-Parrish ketone based model approach toward the tetracyclic core of complex shiartane-type nortriterpenoid natural products

  摘要：

  A concise approach toward the tetracyclic (ABCD) core present in many complex shiartane-type bioactive nortriterpenoids has been conceptualized and executed from the readily available Hajos-Parrish ketone. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2012.11.080
• 作为产物：
  描述：

  1-(tert-butyldimethylsilyloxy)-7a-methyl-2,3,7,7a-tetrahydro-1H-indole-5(6H)-one 在 lithium aluminium tetrahydride 、 sodium hydride 作用下， 以 乙醚 、 二甲基亚砜 为溶剂， 反应 13.0h， 生成 (1S,5S,7aS)-1-[tert-butyl(dimethyl)silyl]oxy-7a-methyl-4-pent-4-enyl-1,2,3,5,6,7-hexahydroinden-5-ol
  参考文献：
  名称：

  A concise, enantiospecific, Hajos-Parrish ketone based model approach toward the tetracyclic core of complex shiartane-type nortriterpenoid natural products

  摘要：

  A concise approach toward the tetracyclic (ABCD) core present in many complex shiartane-type bioactive nortriterpenoids has been conceptualized and executed from the readily available Hajos-Parrish ketone. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2012.11.080

文献信息

• A concise, enantiospecific, Hajos-Parrish ketone based model approach toward the tetracyclic core of complex shiartane-type nortriterpenoid natural products
  作者：Goverdhan Mehta、Srinivasarao Yaragorla

  DOI：10.1016/j.tetlet.2012.11.080

  日期：2013.2

  A concise approach toward the tetracyclic (ABCD) core present in many complex shiartane-type bioactive nortriterpenoids has been conceptualized and executed from the readily available Hajos-Parrish ketone. (C) 2012 Elsevier Ltd. All rights reserved.