4-[2-(3,4-Dihydroxyphenyl)ethenyl]-3-[2-[4-(42-hydroxy-19-phenyl-4-oxa-10,15,21,27,46,48-hexazapentadecacyclo[29.25.5.19,56.120,24.02,7.017,22.024,29.028,44.032,44.032,52.035,39.035,43.045,49.052,60.012,62]trihexaconta-9(62),11,17,40,45(49),46-hexaen-53,57-diyn-26-yl)phenyl]ethyl]naphthalene-1,2,8-triol

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: 4-[2-(3,4-Dihydroxyphenyl)ethenyl]-3-[2-[4-(42-hydroxy-19-phenyl-4-oxa-10,15,21,27,46,48-hexazapentadecacyclo[29.25.5.19,56.120,24.02,7.017,22.024,29.028,44.032,44.032,52.035,39.035,43.045,49.052,60.012,62]trihexaconta-9(62),11,17,40,45(49),46-hexaen-53,57-diyn-26-yl)phenyl]ethyl]naphthalene-1,2,8-triol
• 英文别名: 4-[2-(3,4-dihydroxyphenyl)ethenyl]-3-[2-[4-(42-hydroxy-19-phenyl-4-oxa-10,15,21,27,46,48-hexazapentadecacyclo[29.25.5.19,56.120,24.02,7.017,22.024,29.028,44.032,44.032,52.035,39.035,43.045,49.052,60.012,62]trihexaconta-9(62),11,17,40,45(49),46-hexaen-53,57-diyn-26-yl)phenyl]ethyl]naphthalene-1,2,8-triol
• 化学式: C₈₈H₉₄N₆O₇
• 分子量: 1347.7
• InChiKey: XYRQRXODFFRGGK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  14
• 重原子数：
  101
• 可旋转键数：
  7
• 环数：
  21.0
• sp3杂化的碳原子比例：
  0.49
• 拓扑面积：
  211
• 氢给体数：
  11
• 氢受体数：
  11