[5-[5-[(9,10,11,14,15,16,27,28,29,32,33,34-Dodecahydroxy-6,19,24,37-tetraoxo-2,5,20,23,38-pentaoxaheptacyclo[19.18.0.04,22.07,12.013,18.025,30.031,36]nonatriaconta-7,9,11,13,15,17,25,27,29,31,33,35-dodecaen-3-yl)oxycarbonyl]-2,3-dihydroxyphenoxy]carbonyl-2,3-dihydroxyphenyl] 3,4,5-trihydroxybenzoate

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 单宁
• 英文名称: [5-[5-[(9,10,11,14,15,16,27,28,29,32,33,34-Dodecahydroxy-6,19,24,37-tetraoxo-2,5,20,23,38-pentaoxaheptacyclo[19.18.0.04,22.07,12.013,18.025,30.031,36]nonatriaconta-7,9,11,13,15,17,25,27,29,31,33,35-dodecaen-3-yl)oxycarbonyl]-2,3-dihydroxyphenoxy]carbonyl-2,3-dihydroxyphenyl] 3,4,5-trihydroxybenzoate
• 英文别名: [5-[5-[(9,10,11,14,15,16,27,28,29,32,33,34-dodecahydroxy-6,19,24,37-tetraoxo-2,5,20,23,38-pentaoxaheptacyclo[19.18.0.04,22.07,12.013,18.025,30.031,36]nonatriaconta-7,9,11,13,15,17,25,27,29,31,33,35-dodecaen-3-yl)oxycarbonyl]-2,3-dihydroxyphenoxy]carbonyl-2,3-dihydroxyphenyl] 3,4,5-trihydroxybenzoate
• 化学式: C₅₅H₃₆O₃₄
• 分子量: 1240.8
• InChiKey: YQAMCNPPKHKILT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  89
• 可旋转键数：
  9
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  578
• 氢给体数：
  19
• 氢受体数：
  34