(E,6R)-8-[(1R,4Z,6Z,8E,10R,12R,14R,16S,17E,20R,21S,24R,25S,26S,27E,31E,34S,36S,40R)-25,26-dihydroxy-21,40-dimethyl-3,22-dioxo-2,11,15,35,39-pentaoxapentacyclo[32.2.2.112,16.120,24.010,14]tetraconta-4,6,8,17,27,31,37-heptaen-36-yl]-6-methylnon-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: (E,6R)-8-[(1R,4Z,6Z,8E,10R,12R,14R,16S,17E,20R,21S,24R,25S,26S,27E,31E,34S,36S,40R)-25,26-dihydroxy-21,40-dimethyl-3,22-dioxo-2,11,15,35,39-pentaoxapentacyclo[32.2.2.112,16.120,24.010,14]tetraconta-4,6,8,17,27,31,37-heptaen-36-yl]-6-methylnon-7-enoic acid
• 化学式: C₄₇H₆₄O₁₁
• 分子量: 805.0
• InChiKey: JRJUIQJJXKVDHA-GVWWPDQXSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.2
• 重原子数：
  58
• 可旋转键数：
  7
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.6
• 拓扑面积：
  158
• 氢给体数：
  3
• 氢受体数：
  11