chaetochromin 5,5',8,8'-tetramethyl ether | 108907-50-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 萘并吡喃类
• 英文名称: chaetochromin 5,5',8,8'-tetramethyl ether
• 英文别名: 6-hydroxy-9-(6-hydroxy-5,8-dimethoxy-2,3-dimethyl-4-oxo-2,3-dihydrobenzo[g]chromen-9-yl)-5,8-dimethoxy-2,3-dimethyl-2,3-dihydrobenzo[g]chromen-4-one
• CAS: 108907-50-2
• 化学式: C₃₄H₃₄O₁₀
• 分子量: 602.638
• InChiKey: GHOBIDVZDBSAHN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.1
• 重原子数：
  44
• 可旋转键数：
  5
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  130
• 氢给体数：
  2
• 氢受体数：
  10

反应信息

• 作为反应物：
  描述：

  重氮甲烷 、 chaetochromin 5,5',8,8'-tetramethyl ether 以 乙醚 、 二氯甲烷 为溶剂， 以40 mg的产率得到5,6,8,5',6',8'-Hexamethoxy-2,3,2',3'-tetramethyl-2,3,2',3'-tetrahydro-[9,9']bi[benzo[g]chromenyl]-4,4'-dione
  参考文献：
  名称：

  Chaetochromins B, C and D, bis(naphtho-.GAMMA.-pyrone) derivatives from Chaetomium gracile.

  摘要：

  Besides chaetochromin A (1), a known mycotoxin and antitumor agent, three related bis (naphtho-γ-pyrone) derivatives named chaetochromins B (2), C (3), and D (4) were isolated from Chaetomium gracile. The structures were elucidated as the diastereomer, the 3-demethyl derivative, and the 2, 3-dehydro derivative of 1, respectively, chiefly on the basis of nuclear magnetic resonance data.

  DOI：

  10.1248/cpb.35.578
• 作为产物：
  描述：

  重氮甲烷 、 5,5,6,6,8,8-六羟基-2,2,3,3-四甲基-2H,2H-9,9-bi苯并[g]色烯-4,4(3h,3h)-二酮 以 乙醚 、 二氯甲烷 为溶剂， 反应 4.0h， 以36.8 mg的产率得到chaetochromin 5,5',8,8'-tetramethyl ether
  参考文献：
  名称：

  Chaetochromins B, C and D, bis(naphtho-.GAMMA.-pyrone) derivatives from Chaetomium gracile.

  摘要：

  Besides chaetochromin A (1), a known mycotoxin and antitumor agent, three related bis (naphtho-γ-pyrone) derivatives named chaetochromins B (2), C (3), and D (4) were isolated from Chaetomium gracile. The structures were elucidated as the diastereomer, the 3-demethyl derivative, and the 2, 3-dehydro derivative of 1, respectively, chiefly on the basis of nuclear magnetic resonance data.

  DOI：

  10.1248/cpb.35.578