10-Hydroxyaloin A | 134863-91-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 蒽
• 英文名称: 10-Hydroxyaloin A
• 英文别名: 10-Hydroxyaloin B；(10R)-1,8,10-trihydroxy-3-(hydroxymethyl)-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]anthracen-9-one
• CAS: 134863-91-5
• 化学式: C₂₁H₂₂O₁₀
• 分子量: 434.4
• InChiKey: WRQPROLXESIJKE-CRZBQJGTSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.2
• 重原子数：
  31
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  188
• 氢给体数：
  8
• 氢受体数：
  10

反应信息

• 作为反应物：
  描述：

  10-Hydroxyaloin A 、 乙酸酐 在 zinc(II) chloride 作用下， 反应 0.17h， 生成 Acetic acid (R)-4,5-diacetoxy-2-acetoxymethyl-10-oxo-9-((2R,3R,4S,5R,6R)-3,4,5-triacetoxy-6-acetoxymethyl-tetrahydro-pyran-2-yl)-9,10-dihydro-anthracen-9-yl ester
  参考文献：
  名称：

  Rauwald, Hans W.; Lohse, Karsten; Bats, Jan W., Zeitschrift fur Naturforschung, B: Chemical Sciences, 1991, vol. 46, # 4, p. 551 - 557

  摘要：

  DOI：
• 作为产物：
  描述：

  [(9R)-9-[(2R,3R,4S,5S,6R)-6-(acetyloxymethyl)-3,4,5-trihydroxyoxan-2-yl]-4,5,9-trihydroxy-10-oxoanthracen-2-yl]methyl (2R,3S)-3-hydroxy-2-methylbutanoate 在 盐酸 、 氢氧化钾 作用下， 以 甲醇 、 水 为溶剂， 生成 10-Hydroxyaloin A
  参考文献：
  名称：

  Three oxanthrones from Aloe littoralis

  摘要：

  The leaf exudate of Aloe littoralis yielded, in addition to the known 10-hydroxyaloin B, two new C-glucoside oxanthrones namely 10-hydroxy-15-O-(2R,3S-nilyl)(6'-O-acetyl)aloin B (littoraloin) and 10-hydroxy-15-O-(2R,3S-nilyl)aloin B (deacetyllittoraloin). Their structures were determined by spectroscopic methods as well as by conversion to the known 10-hydroxyaloin B and nilic acid.

  DOI：

  10.1016/0031-9422(96)00163-x

文献信息

• RAUWALD, HANS W.;LOHSE, KARSTEN;BATS, JAN W., Z. NATURFORSCH. B, 46,(1991) N, C. 551-557
  作者：RAUWALD, HANS W.、LOHSE, KARSTEN、BATS, JAN W.

  DOI：——

  日期：——
• Three oxanthrones from Aloe littoralis
  作者：Ermias Dagne、Ben-Erik Van Wyk、David Stephenson、Wolfgang Steglich

  DOI：10.1016/0031-9422(96)00163-x

  日期：1996.8

  The leaf exudate of Aloe littoralis yielded, in addition to the known 10-hydroxyaloin B, two new C-glucoside oxanthrones namely 10-hydroxy-15-O-(2R,3S-nilyl)(6'-O-acetyl)aloin B (littoraloin) and 10-hydroxy-15-O-(2R,3S-nilyl)aloin B (deacetyllittoraloin). Their structures were determined by spectroscopic methods as well as by conversion to the known 10-hydroxyaloin B and nilic acid.
• Rauwald, Hans W.; Lohse, Karsten; Bats, Jan W., Zeitschrift fur Naturforschung, B: Chemical Sciences, 1991, vol. <b> 46, # 4, p. 551 - 557
  作者：Rauwald, Hans W.、Lohse, Karsten、Bats, Jan W.

  DOI：——

  日期：——