(-)-4-[β-D-glucopyranosyl-(1->3)-β-D-glucopyranosyloxy]benzyl alcohol | 1010838-85-3

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (-)-4-[β-D-glucopyranosyl-(1->3)-β-D-glucopyranosyloxy]benzyl alcohol
• 英文别名: Glc(b1-3)Glc(b)-O-Ph(4-CH2OH)；(2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5R,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-[4-(hydroxymethyl)phenoxy]oxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
• CAS: 1010838-85-3
• 化学式: C₁₉H₂₈O₁₂
• 分子量: 448.424
• InChiKey: JHXZOOGLMOQFJO-ZICZAMIASA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -2.4
• 重原子数：
  31
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.68
• 拓扑面积：
  199
• 氢给体数：
  8
• 氢受体数：
  12

反应信息

• 作为产物：
  描述：

  (-)-(2R,3S)-1-(4-β-D-glucopyranosyloxybenzyl)-2-O-β-D-glucopyranosyl-4-{4-[β-D-glucopyranosyl-(1->3)-β-D-glucopyranosyloxy]benzyl}-2-isobutyltartrate 在 sodium hydroxide 、 水 作用下， 反应 2.0h， 以1.9 mg的产率得到coelovirin E
  参考文献：
  名称：

  Glycosidic Constituents of the Tubers of Gymnadenia conopsea

  摘要：

  Ten minor new glycosidic constituents (1-10), together with 10 known compounds, have been isolated from a neuroprotective fraction of an ethanolic extract of the tubers of Gymnadenia conopsea. The structures of 1-10 were determined using spectroscopic and chemical methods. The compounds isolated were evaluated for activity in in vitro assays for acetylcholine esterase and monoamine oxidase inhibitory activities.

  DOI：

  10.1021/np070670j

文献信息

• Glycosidic Constituents of the Tubers of <i>Gymnadenia conopsea</i>
  作者：Jiachen Zi、Shuai Li、Mingtao Liu、Maoluo Gan、Sheng Lin、Weixia Song、Yanling Zhang、Xiaona Fan、Yongchun Yang、Jianjun Zhang、Jiangong Shi、Duolong Di

  DOI：10.1021/np070670j

  日期：2008.5.1

  Ten minor new glycosidic constituents (1-10), together with 10 known compounds, have been isolated from a neuroprotective fraction of an ethanolic extract of the tubers of Gymnadenia conopsea. The structures of 1-10 were determined using spectroscopic and chemical methods. The compounds isolated were evaluated for activity in in vitro assays for acetylcholine esterase and monoamine oxidase inhibitory activities.