3-[5-(3,4-Dihydroxy-4-methyl-5-oxooxolan-2-yl)-2-[6-[3-[5-(3,4-dihydroxy-4-methyl-5-oxooxolan-2-yl)-4-methoxy-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]propanoyloxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-methoxyphenyl]propanoic acid

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 3-[5-(3,4-Dihydroxy-4-methyl-5-oxooxolan-2-yl)-2-[6-[3-[5-(3,4-dihydroxy-4-methyl-5-oxooxolan-2-yl)-4-methoxy-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]propanoyloxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-methoxyphenyl]propanoic acid
• 英文别名: 3-[5-(3,4-dihydroxy-4-methyl-5-oxooxolan-2-yl)-2-[6-[3-[5-(3,4-dihydroxy-4-methyl-5-oxooxolan-2-yl)-4-methoxy-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]propanoyloxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-methoxyphenyl]propanoic acid
• 化学式: C₄₂H₅₄O₂₅
• 分子量: 958.9
• InChiKey: HPDJFHJDZYIBCP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -3.9
• 重原子数：
  67
• 可旋转键数：
  18
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.62
• 拓扑面积：
  394
• 氢给体数：
  12
• 氢受体数：
  25