19-[3-(2,3,4,10a-tetrahydro-1H-phenanthren-4a-yl)phenyl]-8-(4-hydroxy-1-methoxybutan-2-yl)-7-(hydroxymethyl)-46-(1-hydroxypropan-2-ylidene)-2,10,14,44-tetraoxaundecacyclo[24.16.6.51,23.03,12.06,11.013,43.017,22.030,42.031,40.034,39.027,49]tripentaconta-3(12),4,6(11),7,20,23(49),24,26,32,34,36,38-dodecaen-51-yne-9,15,45-trione

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 香豆素及其衍生物
• 英文名称: 19-[3-(2,3,4,10a-tetrahydro-1H-phenanthren-4a-yl)phenyl]-8-(4-hydroxy-1-methoxybutan-2-yl)-7-(hydroxymethyl)-46-(1-hydroxypropan-2-ylidene)-2,10,14,44-tetraoxaundecacyclo[24.16.6.51,23.03,12.06,11.013,43.017,22.030,42.031,40.034,39.027,49]tripentaconta-3(12),4,6(11),7,20,23(49),24,26,32,34,36,38-dodecaen-51-yne-9,15,45-trione
• 化学式: C₇₈H₇₈O₁₁
• 分子量: 1191.4
• InChiKey: AOIIQHPKSOYRHO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  13.4
• 重原子数：
  89
• 可旋转键数：
  9
• 环数：
  15.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  158
• 氢给体数：
  3
• 氢受体数：
  11