4-Ethyl-19-hydroxy-23-(hydroxymethyl)-32-(4-hydroxyphenyl)-28-(3-hydroxy-5-phenylpent-4-enoxy)-27-methoxy-25,33-dioxa-5,7,10-triazaoctacyclo[36.3.1.114,18.02,6.07,12.017,22.026,35.029,34]tritetraconta-1(41),2(6),3,14(43),15,17,20,26,28,31,34,38(42),39-tridecaen-30-one

• 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: 4-Ethyl-19-hydroxy-23-(hydroxymethyl)-32-(4-hydroxyphenyl)-28-(3-hydroxy-5-phenylpent-4-enoxy)-27-methoxy-25,33-dioxa-5,7,10-triazaoctacyclo[36.3.1.114,18.02,6.07,12.017,22.026,35.029,34]tritetraconta-1(41),2(6),3,14(43),15,17,20,26,28,31,34,38(42),39-tridecaen-30-one
• 英文别名: 4-ethyl-19-hydroxy-23-(hydroxymethyl)-32-(4-hydroxyphenyl)-28-(3-hydroxy-5-phenylpent-4-enoxy)-27-methoxy-25,33-dioxa-5,7,10-triazaoctacyclo[36.3.1.114,18.02,6.07,12.017,22.026,35.029,34]tritetraconta-1(41),2(6),3,14(43),15,17,20,26,28,31,34,38(42),39-tridecaen-30-one
• 化学式: C₅₉H₆₁N₃O₉
• 分子量: 956.1
• InChiKey: OORUIKOSYBEMAU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9
• 重原子数：
  71
• 可旋转键数：
  10
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  166
• 氢给体数：
  6
• 氢受体数：
  11