[2,4-Bis(octadeca-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17-heptadecaenylcarbamoyloxy)-1,3,5-tris(octadecylcarbamoyloxy)pentyl]-[6-[[2,4-bis(octadeca-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17-heptadecaenylcarbamoyloxy)-1,3,5-tris(octadecylcarbamoyloxy)pentyl]-methylamino]-9-(2-carboxyphenyl)xanthen-3-ylidene]-methylazanium

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并吡喃
• 英文名称: [2,4-Bis(octadeca-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17-heptadecaenylcarbamoyloxy)-1,3,5-tris(octadecylcarbamoyloxy)pentyl]-[6-[[2,4-bis(octadeca-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17-heptadecaenylcarbamoyloxy)-1,3,5-tris(octadecylcarbamoyloxy)pentyl]-methylamino]-9-(2-carboxyphenyl)xanthen-3-ylidene]-methylazanium
• 英文别名: [2,4-bis(octadeca-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17-heptadecaenylcarbamoyloxy)-1,3,5-tris(octadecylcarbamoyloxy)pentyl]-[6-[[2,4-bis(octadeca-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17-heptadecaenylcarbamoyloxy)-1,3,5-tris(octadecylcarbamoyloxy)pentyl]-methylamino]-9-(2-carboxyphenyl)xanthen-3-ylidene]-methylazanium
• 化学式: C222H273N12O23+
• 分子量: 3478.0
• InChiKey: KDBDCYPQDZCYLP-UHFFFAOYSA-O

计算性质

• 辛醇/水分配系数(LogP)：
  30.3
• 重原子数：
  257
• 可旋转键数：
  139
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  436
• 氢给体数：
  11
• 氢受体数：
  24