1-[1-[4a-[1-[5-[13-(Ethylaminomethoxy)-3,11-dihydroxy-15-[2-(methylamino)ethoxy]-6-oxa-10-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),8,12,14,16(20)-hexaen-4-yl]-2-hydroxy-3-methoxyphenoxy]-3-hydroxypropan-2-yl]spiro[1,3,4,10a-tetrahydrophenanthrene-2,1'-cyclopentane]-1-yl]cyclohexyl]pyrrole-2,5-dione

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 异黄酮类化合物
• 英文名称: 1-[1-[4a-[1-[5-[13-(Ethylaminomethoxy)-3,11-dihydroxy-15-[2-(methylamino)ethoxy]-6-oxa-10-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),8,12,14,16(20)-hexaen-4-yl]-2-hydroxy-3-methoxyphenoxy]-3-hydroxypropan-2-yl]spiro[1,3,4,10a-tetrahydrophenanthrene-2,1'-cyclopentane]-1-yl]cyclohexyl]pyrrole-2,5-dione
• 英文别名: 1-[1-[4a-[1-[5-[13-(ethylaminomethoxy)-3,11-dihydroxy-15-[2-(methylamino)ethoxy]-6-oxa-10-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),8,12,14,16(20)-hexaen-4-yl]-2-hydroxy-3-methoxyphenoxy]-3-hydroxypropan-2-yl]spiro[1,3,4,10a-tetrahydrophenanthrene-2,1'-cyclopentane]-1-yl]cyclohexyl]pyrrole-2,5-dione
• 化学式: C₆₂H₇₄N₄O₁₁
• 分子量: 1051.3
• InChiKey: WWTBHADHAYQIOI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.6
• 重原子数：
  77
• 可旋转键数：
  17
• 环数：
  12.0
• sp3杂化的碳原子比例：
  0.52
• 拓扑面积：
  201
• 氢给体数：
  7
• 氢受体数：
  14