3-(hex-1-en-1-yl)-5-hydroxy-5-(hydroxymethyl)-4-methylfuran-2(5H)-one | 1337537-11-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二氢呋喃
• 英文名称: 3-(hex-1-en-1-yl)-5-hydroxy-5-(hydroxymethyl)-4-methylfuran-2(5H)-one
• 英文别名: JBIR-89；3-Hex-1-enyl-5-hydroxy-5-(hydroxymethyl)-4-methylfuran-2-one；3-hex-1-enyl-5-hydroxy-5-(hydroxymethyl)-4-methylfuran-2-one
• CAS: 1337537-11-7
• 化学式: C₁₂H₁₈O₄
• 分子量: 226.273
• InChiKey: NIJVXGHTKASCQE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  16
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.58
• 拓扑面积：
  66.8
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  3-(hex-1-en-1-yl)-5-hydroxy-5-(hydroxymethyl)-4-methylfuran-2(5H)-one 、 乙酸酐 在 吡啶 作用下， 反应 2.0h， 生成 (2-acetyloxy-4-hex-1-enyl-3-methyl-5-oxofuran-2-yl)methyl acetate
  参考文献：
  名称：

  A new angucycline and a new butenolide isolated from lichen-derived Streptomyces spp.

  摘要：

  A new 1,1-dichlorocyclopropane-containing angucycline, JBIR-88 (1), and a new butenolide, JBIR-89 (2), respectively, were isolated from the fermentation broths of two lichen-derived actinomycetes identified as a new species of Streptomyces (strains RI104-LiC106 and RI104-LiB101) using phylogenetic methods. The structures of 1 and 2 were elucidated on the basis of 1D and 2D NMR spectroscopy and MS analyses. Compound 1 showed cytotoxic activities against cancer cells and antimicrobial activity against Micrococcus luteus.

  DOI：

  10.1038/ja.2010.94

文献信息

• A new angucycline and a new butenolide isolated from lichen-derived Streptomyces spp.
  作者：Keiichiro Motohashi、Motoki Takagi、Hideki Yamamura、Masayuki Hayakawa、Kazuo Shin-ya

  DOI：10.1038/ja.2010.94

  日期：2010.9

  A new 1,1-dichlorocyclopropane-containing angucycline, JBIR-88 (1), and a new butenolide, JBIR-89 (2), respectively, were isolated from the fermentation broths of two lichen-derived actinomycetes identified as a new species of Streptomyces (strains RI104-LiC106 and RI104-LiB101) using phylogenetic methods. The structures of 1 and 2 were elucidated on the basis of 1D and 2D NMR spectroscopy and MS analyses. Compound 1 showed cytotoxic activities against cancer cells and antimicrobial activity against Micrococcus luteus.