3-Hydroxy-1-[14-hydroxy-2-(hydroxymethoxy)-7-[3-hydroxy-5-(methylaminomethyl)phenyl]-14-methyl-18-oxa-11,12-dithia-16-azatricyclo[8.8.1.05,19]nonadeca-1,3,5(19)-trien-7-yl]-4-[[4-hydroxy-3-methoxy-2-(naphthalen-1-ylmethyl)phenyl]methyl]-5-pyrrol-1-id-3-ylpentan-1-one

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 3-Hydroxy-1-[14-hydroxy-2-(hydroxymethoxy)-7-[3-hydroxy-5-(methylaminomethyl)phenyl]-14-methyl-18-oxa-11,12-dithia-16-azatricyclo[8.8.1.05,19]nonadeca-1,3,5(19)-trien-7-yl]-4-[[4-hydroxy-3-methoxy-2-(naphthalen-1-ylmethyl)phenyl]methyl]-5-pyrrol-1-id-3-ylpentan-1-one
• 英文别名: 3-hydroxy-1-[14-hydroxy-2-(hydroxymethoxy)-7-[3-hydroxy-5-(methylaminomethyl)phenyl]-14-methyl-18-oxa-11,12-dithia-16-azatricyclo[8.8.1.05,19]nonadeca-1,3,5(19)-trien-7-yl]-4-[[4-hydroxy-3-methoxy-2-(naphthalen-1-ylmethyl)phenyl]methyl]-5-pyrrol-1-id-3-ylpentan-1-one
• 化学式: C53H60N3O9S2-
• 分子量: 947.2
• InChiKey: DUZWYYJDEOUJJL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.6
• 重原子数：
  67
• 可旋转键数：
  16
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  222
• 氢给体数：
  7
• 氢受体数：
  14