2-[14-(Hydroxymethyl)-5-(4-hydroxyphenyl)-9-(3-hydroxy-5-phenylpent-4-enoxy)-10-methoxy-31-methyl-7-oxo-4,12-dioxa-36,39,51-triazaundecacyclo[32.8.6.216,19.120,23.120,36.125,29.132,35.144,48.02,11.03,8.040,50]pentapentaconta-2(11),3(8),5,9,16,18,25,27,29(52),32,34,44(49),45,47,54-pentadecaen-41-yn-17-yl]guanidine

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 黄酮类化合物
• 英文名称: 2-[14-(Hydroxymethyl)-5-(4-hydroxyphenyl)-9-(3-hydroxy-5-phenylpent-4-enoxy)-10-methoxy-31-methyl-7-oxo-4,12-dioxa-36,39,51-triazaundecacyclo[32.8.6.216,19.120,23.120,36.125,29.132,35.144,48.02,11.03,8.040,50]pentapentaconta-2(11),3(8),5,9,16,18,25,27,29(52),32,34,44(49),45,47,54-pentadecaen-41-yn-17-yl]guanidine
• 英文别名: 2-[14-(hydroxymethyl)-5-(4-hydroxyphenyl)-9-(3-hydroxy-5-phenylpent-4-enoxy)-10-methoxy-31-methyl-7-oxo-4,12-dioxa-36,39,51-triazaundecacyclo[32.8.6.216,19.120,23.120,36.125,29.132,35.144,48.02,11.03,8.040,50]pentapentaconta-2(11),3(8),5,9,16,18,25,27,29(52),32,34,44(49),45,47,54-pentadecaen-41-yn-17-yl]guanidine
• 化学式: C₇₁H₇₂N₆O₈
• 分子量: 1137.4
• InChiKey: AOAXEBIRDVODGG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.7
• 重原子数：
  85
• 可旋转键数：
  10
• 环数：
  14.0
• sp3杂化的碳原子比例：
  0.32
• 拓扑面积：
  210
• 氢给体数：
  7
• 氢受体数：
  11