Merle 28 | 1103935-90-5

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 大环内酯类和类似物
• 英文名称: Merle 28
• 英文别名: [(1S,3S,7R,8E,11S,12S,13E,15S,17R,21R,23R,25S)-25-acetyloxy-1,11,21-trihydroxy-17-[(1R)-1-hydroxyethyl]-13-(2-methoxy-2-oxoethylidene)-10,10,26,26-tetramethyl-5-methylidene-19-oxo-18,27,28,29-tetraoxatetracyclo[21.3.1.13,7.111,15]nonacos-8-en-12-yl] (2E,4E)-octa-2,4-dienoate
• CAS: 1103935-90-5
• 化学式: C₄₅H₆₆O₁₅
• 分子量: 847.01
• InChiKey: BBCVPLHMPIJNDS-ATQCOATKSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.5
• 重原子数：
  60
• 可旋转键数：
  11
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.69
• 拓扑面积：
  214
• 氢给体数：
  4
• 氢受体数：
  15

反应信息

• 作为产物：
  描述：

  在 lithium tetrafluoroborate 、 水 作用下， 以 乙腈 为溶剂， 反应 24.0h， 以83%的产率得到Merle 28
  参考文献：
  名称：

  Substitution on the A-Ring Confers to Bryopyran Analogues the Unique Biological Activity Characteristic of Bryostatins and Distinct From That of the Phorbol Esters

  摘要：

  A close structural analogue of bryostatin 1, which differs from bryostatin 1 only by the absence of the C-30 carbomethoxy group (on the C-13 enoate of the B-ring), has been prepared by total synthesis. Biological assays reveal a crucial role for substitution in the bryostatin 1 A-ring in conferring those responses which are characteristic of bryostatin 1 and distinct from those observed with PMA.

  DOI：

  10.1021/ol8027253

文献信息

• BRYOSTATIN ANALOGS AND USE THEREOF AS ANTIVIRAL AGENTS
  申请人：UNIVERSITY OF UTAH RESEARCH FOUNDATION

  公开号：US20170239212A1

  公开（公告）日：2017-08-24

  Described herein are tricyclic macrolactones. The macrolactones have a high binding affinity for PKC. The compounds described herein can be used in a number of therapeutic applications including the treatment or prevention of viral infection. Also described herein are methods for producing macrolactones. The methods permit the high-yield synthesis of macrolactones in a low number of steps and with a high degree of substitution and specificity.
• US9096550B2
  申请人：——

  公开号：US9096550B2

  公开（公告）日：2015-08-04