pafuranone A

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: pafuranone A
• 英文别名: Pafuranone A；(5R)-5-[(1E,3E)-hexa-1,3-dienyl]-2-[(2R)-2-[(2R)-2-[(1E,3E)-hexa-1,3-dienyl]-2,6-dimethyl-3,4-dioxofuro[3,2-c]pyran-7-yl]propyl]-5-methyl-4-oxofuran-3-carboxylic acid
• 化学式: C₃₀H₃₄O₈
• 分子量: 522.595
• InChiKey: SEXVUFSUQVYADQ-BYZLVFGUSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.8
• 重原子数：
  38
• 可旋转键数：
  10
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  116
• 氢给体数：
  1
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  pafuranone A 在 potassium permanganate 、 硫酸 作用下， 生成 (R)-(+)-甲基丁二酸
  参考文献：
  名称：

  Pafuranones A and B, two dimeric polyketides from a rare marine algae-derived fungus Paraconiothyrium sp.

  摘要：

  Pafuranones A (1) and B (2), a pair of new epimeric polyketide dimers, were isolated from the fungus Paraconiothyrium sp. OUCMDZ-3316 associated with the marine algae Enteromorpha prolifera. Their structures, including absolute configurations, were fully elucidated based on spectroscopic analysis, calculated ECD, and chemical methods. Pafuranones A (1) and B (2) possess a rare dimeric furanone skeleton, which might be formed through a conjugate addition of the monomeric units followed by an intramolecular cyclization. (C) 2019 Chinese Chemical Society and Institute of Materia Medica, Chinese Academy of Medical Sciences. Published by Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.cclet.2019.01.034