| 602303-53-7

• 分子结构分类: 有机化合物 - 有机杂环化合物
• CAS: 602303-53-7
• 化学式: C₂₉H₂₄ClNO₁₀
• 分子量: 581.963
• InChiKey: WVNBGUARQSEHSG-FQMVRHRASA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.87
• 重原子数：
  41.0
• 可旋转键数：
  3.0
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.34
• 拓扑面积：
  146.78
• 氢给体数：
  2.0
• 氢受体数：
  11.0

反应信息

• 作为反应物：
  描述：

  甲氧基-三氟甲基苯 、 在 吡啶 作用下， 反应 12.0h， 以58%的产率得到
  参考文献：
  名称：

  Xantholipin, a novel inhibitor of HSP47 gene expression produced by Streptomyces sp.

  摘要：

  In the course of our screening program to identify inhibitors of HSP47 gene expression, we obtained a novel aromatic substance frorn Streptomyces sp. named Xantholipin. Its structure was determined based on physicochemical data of Xantholipin and its derivatives. The absolute configuration was also established by the modified Mosher's method. (C) 2003 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(03)01318-2
• 作为产物：
  描述：

  、 碘甲烷 在 sodium tetrahydroborate 作用下， 以 甲醇 为溶剂， 反应 0.5h， 以60%的产率得到
  参考文献：
  名称：

  Xantholipin, a novel inhibitor of HSP47 gene expression produced by Streptomyces sp.

  摘要：

  In the course of our screening program to identify inhibitors of HSP47 gene expression, we obtained a novel aromatic substance frorn Streptomyces sp. named Xantholipin. Its structure was determined based on physicochemical data of Xantholipin and its derivatives. The absolute configuration was also established by the modified Mosher's method. (C) 2003 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(03)01318-2