Heratomol; 6-羟基-2H-呋喃并[2,3-h]-1-苯并吡喃-2-酮 | 61265-07-4

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 香豆素及其衍生物
• 中文名称: Heratomol; 6-羟基-2H-呋喃并[2,3-h]-1-苯并吡喃-2-酮
• 中文别名: 6-羟基-2H-呋喃并[2,3-H]-1-苯并吡喃-2-酮
• 英文名称: heratomol
• 英文别名: 6-hydroxyfuro[2,3-h]chromen-2-one
• CAS: 61265-07-4
• 化学式: C₁₁H₆O₄
• 分子量: 202.166
• InChiKey: ZKCVFMVZXPEHMD-UHFFFAOYSA-N

物化性质

• 密度：
  1.526

计算性质

• 辛醇/水分配系数(LogP)：
  1.8
• 重原子数：
  15
• 可旋转键数：
  0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  59.7
• 氢给体数：
  1
• 氢受体数：
  4

安全信息

• 海关编码：
  2932999099

反应信息

• 作为反应物：
  描述：

  Heratomol; 6-羟基-2H-呋喃并[2,3-h]-1-苯并吡喃-2-酮 在 氨 、 silver(l) oxide 作用下， 以 喹啉 、 甲醇 为溶剂， 生成 6-O-β-D-glucopyranosylheratomol
  参考文献：
  名称：

  Jain, S. M.; Dhar, K. L.; Atal, C. K., Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1985, vol. 24, p. 454 - 455

  摘要：

  DOI：
• 作为产物：
  描述：

  6-phenylmethoxyfuro[2,3-h]chromen-2-one 在 palladium dihydroxide 氢气 作用下， 以 甲醇 、 乙酸乙酯 为溶剂， 反应 1.0h， 以59%的产率得到Heratomol; 6-羟基-2H-呋喃并[2,3-h]-1-苯并吡喃-2-酮
  参考文献：
  名称：

  Synthesis and antifungal activity of coumarins and angular furanocoumarins

  摘要：

  Angelicin, a naturally occurring furanocoumarin, that showed antifungal activity, was considered as a lead structure for a group of synthetic coumarins. Antifungal activities of the synthesized coumarins and angelicin derivatives were reported against Candida albicans, Cryptococcus neoformans, Saccharomyces cerevisiae and Aspergillus niger. Human cell line cytotoxicity of several coumarins was evaluated against KB cells. Angelicin and several potent antifungals showed to be non-toxic in this assay.

  DOI：

  10.1016/s0968-0896(99)00138-8

文献信息

• Singh, Kuber; Banerjee, S.K.; Atal, C.K., Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1981, vol. 20, # 2, p. 108 - 110
  作者：Singh, Kuber、Banerjee, S.K.、Atal, C.K.

  DOI：——

  日期：——
• SINGH, KUBER;BANERJEE, S. K.;ATAL, C. K., INDIAN J. CHEM., 1981, 20, N 2, 108-110
  作者：SINGH, KUBER、BANERJEE, S. K.、ATAL, C. K.

  DOI：——

  日期：——
• Synthesis and antifungal activity of coumarins and angular furanocoumarins
  作者：Soroush Sardari、Yoki Mori、Kiyoshi Horita、Ronald G Micetich、Sansei Nishibe、Mohsen Daneshtalab

  DOI：10.1016/s0968-0896(99)00138-8

  日期：1999.9

  Angelicin, a naturally occurring furanocoumarin, that showed antifungal activity, was considered as a lead structure for a group of synthetic coumarins. Antifungal activities of the synthesized coumarins and angelicin derivatives were reported against Candida albicans, Cryptococcus neoformans, Saccharomyces cerevisiae and Aspergillus niger. Human cell line cytotoxicity of several coumarins was evaluated against KB cells. Angelicin and several potent antifungals showed to be non-toxic in this assay.
• Jain, S. M.; Dhar, K. L.; Atal, C. K., Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1985, vol. 24, p. 454 - 455
  作者：Jain, S. M.、Dhar, K. L.、Atal, C. K.

  DOI：——

  日期：——