11,19,21,27,62-Pentahydroxy-20-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-17-(hydroxymethoxy)-57-methyl-9,37-dioxa-23,24,46,47-tetrathia-35,42,50-triazaundecacyclo[39.19.3.14,8.110,14.132,35.04,55.05,49.013,25.028,33.044,63.055,60]hexahexaconta-10,12,14(65),28,30,32(64),33-heptaen-53-yn-43-one

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: 11,19,21,27,62-Pentahydroxy-20-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-17-(hydroxymethoxy)-57-methyl-9,37-dioxa-23,24,46,47-tetrathia-35,42,50-triazaundecacyclo[39.19.3.14,8.110,14.132,35.04,55.05,49.013,25.028,33.044,63.055,60]hexahexaconta-10,12,14(65),28,30,32(64),33-heptaen-53-yn-43-one
• 英文别名: 11,19,21,27,62-pentahydroxy-20-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-17-(hydroxymethoxy)-57-methyl-9,37-dioxa-23,24,46,47-tetrathia-35,42,50-triazaundecacyclo[39.19.3.14,8.110,14.132,35.04,55.05,49.013,25.028,33.044,63.055,60]hexahexaconta-10,12,14(65),28,30,32(64),33-heptaen-53-yn-43-one
• 化学式: C₆₈H₉₁N₃O₁₃S₄
• 分子量: 1286.7
• InChiKey: ZMXOFWATFJHUQD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.9
• 重原子数：
  88
• 可旋转键数：
  6
• 环数：
  15.0
• sp3杂化的碳原子比例：
  0.66
• 拓扑面积：
  335
• 氢给体数：
  9
• 氢受体数：
  18