6-[6-[4,5-Dihydroxy-6-[[3,4,5-trihydroxy-6-[(13-hydroxy-7,14-dimethoxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaen-6-yl)oxy]oxan-2-yl]methoxy]oxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 单宁
• 英文名称: 6-[6-[4,5-Dihydroxy-6-[[3,4,5-trihydroxy-6-[(13-hydroxy-7,14-dimethoxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaen-6-yl)oxy]oxan-2-yl]methoxy]oxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
• 英文别名: 6-[6-[4,5-dihydroxy-6-[[3,4,5-trihydroxy-6-[(13-hydroxy-7,14-dimethoxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaen-6-yl)oxy]oxan-2-yl]methoxy]oxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
• 化学式: C₃₈H₄₄O₂₇
• 分子量: 932.7
• InChiKey: ANNRZHOXXQKCEK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -5
• 重原子数：
  65
• 可旋转键数：
  12
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.61
• 拓扑面积：
  405
• 氢给体数：
  12
• 氢受体数：
  27