Hexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58-nonacosayne;methyl 6-methyl-5-phenyl-5-propan-2-ylheptanoate;4-(29-undecyl-30-azaheptadecacyclo[10.8.8.813,17.75,28.04,22.08,34.09,32.016,42.020,37.021,38.023,35.024,39.025,33.026,40.027,43.028,32.036,41]tritetraconta-5(35),6,8,10,12,14,16(42),21(38),22,24(39),25,27(43),33,36,40-pentadecaen-30-yl)phenol

• 分子结构分类: 有机化合物 - 苯类化合物 - 菲及其衍生物
• 英文名称: Hexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58-nonacosayne;methyl 6-methyl-5-phenyl-5-propan-2-ylheptanoate;4-(29-undecyl-30-azaheptadecacyclo[10.8.8.813,17.75,28.04,22.08,34.09,32.016,42.020,37.021,38.023,35.024,39.025,33.026,40.027,43.028,32.036,41]tritetraconta-5(35),6,8,10,12,14,16(42),21(38),22,24(39),25,27(43),33,36,40-pentadecaen-30-yl)phenol
• 英文别名: hexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58-nonacosayne;methyl 6-methyl-5-phenyl-5-propan-2-ylheptanoate;4-(29-undecyl-30-azaheptadecacyclo[10.8.8.813,17.75,28.04,22.08,34.09,32.016,42.020,37.021,38.023,35.024,39.025,33.026,40.027,43.028,32.036,41]tritetraconta-5(35),6,8,10,12,14,16(42),21(38),22,24(39),25,27(43),33,36,40-pentadecaen-30-yl)phenol
• 化学式: C137H83NO3
• 分子量: 1791.1
• InChiKey: RKZNWAKQOGTAMI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  18.32
• 重原子数：
  141
• 可旋转键数：
  47
• 环数：
  19.0
• sp3杂化的碳原子比例：
  0.26
• 拓扑面积：
  49.8
• 氢给体数：
  1
• 氢受体数：
  4