3-oxo-3-[[3,4,5-trihydroxy-6-[[7-hydroxy-3-[3,4,5-trihydroxy-6-[3-[3-hydroxy-4-[3,4,5-trihydroxy-6-[3-[4-hydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoyloxymethyl]oxan-2-yl]oxyphenyl]prop-2-enoyloxymethyl]oxan-2-yl]oxy-2-(3,4,5-trihydroxyphenyl)-2H-chromen-5-yl]oxy]oxan-2-yl]methoxy]propanoic acid

• 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: 3-oxo-3-[[3,4,5-trihydroxy-6-[[7-hydroxy-3-[3,4,5-trihydroxy-6-[3-[3-hydroxy-4-[3,4,5-trihydroxy-6-[3-[4-hydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoyloxymethyl]oxan-2-yl]oxyphenyl]prop-2-enoyloxymethyl]oxan-2-yl]oxy-2-(3,4,5-trihydroxyphenyl)-2H-chromen-5-yl]oxy]oxan-2-yl]methoxy]propanoic acid
• 化学式: C₆₀H₆₆O₃₆
• 分子量: 1363.1
• InChiKey: LYILUNJOHHVUOO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -3.2
• 重原子数：
  96
• 可旋转键数：
  25
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  584
• 氢给体数：
  20
• 氢受体数：
  36