[3,4,5,13,21,22,23-Heptamethoxy-8,18-dioxo-11-(3,4,5-trimethoxybenzoyl)oxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaen-12-yl] 2-[[4,5,18,19,20,23,24,25,38,39-decamethoxy-9,15,28,35-tetraoxo-12-(3,4,5-trimethoxybenzoyl)oxy-2,10,14,29,32,34-hexaoxaheptacyclo[34.3.1.03,8.011,33.013,31.016,21.022,27]tetraconta-1(39),3,5,7,16,18,20,22,24,26,36(40),37-dodecaen-6-yl]oxy]-3,4,5-trimethoxybenzoate

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 单宁
• 英文名称: [3,4,5,13,21,22,23-Heptamethoxy-8,18-dioxo-11-(3,4,5-trimethoxybenzoyl)oxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaen-12-yl] 2-[[4,5,18,19,20,23,24,25,38,39-decamethoxy-9,15,28,35-tetraoxo-12-(3,4,5-trimethoxybenzoyl)oxy-2,10,14,29,32,34-hexaoxaheptacyclo[34.3.1.03,8.011,33.013,31.016,21.022,27]tetraconta-1(39),3,5,7,16,18,20,22,24,26,36(40),37-dodecaen-6-yl]oxy]-3,4,5-trimethoxybenzoate
• 英文别名: [3,4,5,13,21,22,23-heptamethoxy-8,18-dioxo-11-(3,4,5-trimethoxybenzoyl)oxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaen-12-yl] 2-[[4,5,18,19,20,23,24,25,38,39-decamethoxy-9,15,28,35-tetraoxo-12-(3,4,5-trimethoxybenzoyl)oxy-2,10,14,29,32,34-hexaoxaheptacyclo[34.3.1.03,8.011,33.013,31.016,21.022,27]tetraconta-1(39),3,5,7,16,18,20,22,24,26,36(40),37-dodecaen-6-yl]oxy]-3,4,5-trimethoxybenzoate
• 化学式: C₁₀₁H₁₀₄O₄₈
• 分子量: 2085.9
• InChiKey: RBTCGDBDESONHB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.3
• 重原子数：
  149
• 可旋转键数：
  37
• 环数：
  14.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  514
• 氢给体数：
  0
• 氢受体数：
  48