hesperetin-7-O-[β-D-glucopyranosyl-(1→3)]-β-D-glucopyranosyl | 1554106-34-1

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 黄酮类化合物
• 英文名称: hesperetin-7-O-[β-D-glucopyranosyl-(1→3)]-β-D-glucopyranosyl
• 英文别名: (2S)-7-[(2S,3R,4S,5R,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydrochromen-4-one
• CAS: 1554106-34-1
• 化学式: C₂₈H₃₄O₁₆
• 分子量: 626.568
• InChiKey: YRCYDJMPWDOVBV-OOGUZJMLSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1
• 重原子数：
  44
• 可旋转键数：
  8
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  255
• 氢给体数：
  9
• 氢受体数：
  16

反应信息

• 作为反应物：
  描述：

  hesperetin-7-O-[β-D-glucopyranosyl-(1→3)]-β-D-glucopyranosyl 在 盐酸 、 sodium hydroxide 作用下， 以 甲醇 、 水 为溶剂， 反应 8.0h， 以7 mg的产率得到葡萄糖
  参考文献：
  名称：

  A new flavonoid glycoside from the rhizomes and roots ofSmilax scobinicaulis

  摘要：

  A new flavonoid glycoside, hesperetin-7-O-[beta-d-glucopyranosyl-(1 -> 3)]-beta-d-glucopyranosyl (1), was isolated from the n-BuOH extract of Smilax scobinicaulis, together with four known flavonoid glycosides, clematine (2), ononin (3), daidzin (4) and puerarin (5). All of the five compounds were reported from this material for the first time. Their structures were determined on the basis of spectroscopic and spectrometric methods.

  DOI：

  10.1080/14786419.2014.880913

文献信息

• A new flavonoid glycoside from the rhizomes and roots of<i>Smilax scobinicaulis</i>
  作者：Jing Xu、Shixiu Feng、Qi Wang、Min Zhang、Cunli Zhang

  DOI：10.1080/14786419.2014.880913

  日期：2014.4.18

  A new flavonoid glycoside, hesperetin-7-O-[beta-d-glucopyranosyl-(1 -> 3)]-beta-d-glucopyranosyl (1), was isolated from the n-BuOH extract of Smilax scobinicaulis, together with four known flavonoid glycosides, clematine (2), ononin (3), daidzin (4) and puerarin (5). All of the five compounds were reported from this material for the first time. Their structures were determined on the basis of spectroscopic and spectrometric methods.