6-Methyl-8-(13,21,24,25-tetrahydroxy-14,20-dimethyl-3,10-dioxo-2,34,38,39-tetraoxatetracyclo[31.2.2.111,15.119,23]nonatriaconta-4,6,8,16,26,30,36-heptaen-35-yl)non-7-enoic acid

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 大环内酯类和类似物
• 英文名称: 6-Methyl-8-(13,21,24,25-tetrahydroxy-14,20-dimethyl-3,10-dioxo-2,34,38,39-tetraoxatetracyclo[31.2.2.111,15.119,23]nonatriaconta-4,6,8,16,26,30,36-heptaen-35-yl)non-7-enoic acid
• 英文别名: 6-methyl-8-(13,21,24,25-tetrahydroxy-14,20-dimethyl-3,10-dioxo-2,34,38,39-tetraoxatetracyclo[31.2.2.111,15.119,23]nonatriaconta-4,6,8,16,26,30,36-heptaen-35-yl)non-7-enoic acid
• 化学式: C₄₇H₆₆O₁₂
• 分子量: 823.0
• InChiKey: MWWCZZDDBKWDIT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.8
• 重原子数：
  59
• 可旋转键数：
  7
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.6
• 拓扑面积：
  189
• 氢给体数：
  5
• 氢受体数：
  12