3-Ethyl-5-[20-hydroxy-21-[3-[2-hydroxy-2-(3-hydroxypropoxy)ethyl]-1-(methylaminomethyl)cyclopentyl]oxy-7-[(4-hydroxy-3-methoxyphenyl)methyl]-17-methylimino-6-oxospiro[13,14-dithia-16,18-diazatricyclo[17.3.1.07,11]tricosa-1(23),4,19,21-tetraene-2,1'-cyclopentane]-3-yl]pentanal

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: 3-Ethyl-5-[20-hydroxy-21-[3-[2-hydroxy-2-(3-hydroxypropoxy)ethyl]-1-(methylaminomethyl)cyclopentyl]oxy-7-[(4-hydroxy-3-methoxyphenyl)methyl]-17-methylimino-6-oxospiro[13,14-dithia-16,18-diazatricyclo[17.3.1.07,11]tricosa-1(23),4,19,21-tetraene-2,1'-cyclopentane]-3-yl]pentanal
• 英文别名: 3-ethyl-5-[20-hydroxy-21-[3-[2-hydroxy-2-(3-hydroxypropoxy)ethyl]-1-(methylaminomethyl)cyclopentyl]oxy-7-[(4-hydroxy-3-methoxyphenyl)methyl]-17-methylimino-6-oxospiro[13,14-dithia-16,18-diazatricyclo[17.3.1.07,11]tricosa-1(23),4,19,21-tetraene-2,1'-cyclopentane]-3-yl]pentanal
• 化学式: C₅₁H₇₆N₄O₉S₂
• 分子量: 953.3
• InChiKey: JSSZVIFQCKYAGS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.1
• 重原子数：
  66
• 可旋转键数：
  19
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  242
• 氢给体数：
  7
• 氢受体数：
  13