6-[2-Amino-6-(3-hydroxypropyl)-1,2-dihydropyridin-5-yl]-22-[1-(3,7-dihydroxy-13-propyl-9-oxatricyclo[8.5.0.02,8]pentadecan-7-yl)-1-hydroxyethyl]-3,12,13,19-tetrahydroxy-23-(hydroxymethyl)-17-(2-hydroxypropylamino)heptacyclo[13.7.4.16,10.01,19.03,9.09,18.010,15]heptacosa-4,7,17-trien-24-yn-16-one

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 类固醇和类固醇衍生物
• 英文名称: 6-[2-Amino-6-(3-hydroxypropyl)-1,2-dihydropyridin-5-yl]-22-[1-(3,7-dihydroxy-13-propyl-9-oxatricyclo[8.5.0.02,8]pentadecan-7-yl)-1-hydroxyethyl]-3,12,13,19-tetrahydroxy-23-(hydroxymethyl)-17-(2-hydroxypropylamino)heptacyclo[13.7.4.16,10.01,19.03,9.09,18.010,15]heptacosa-4,7,17-trien-24-yn-16-one
• 英文别名: 6-[2-amino-6-(3-hydroxypropyl)-1,2-dihydropyridin-5-yl]-22-[1-(3,7-dihydroxy-13-propyl-9-oxatricyclo[8.5.0.02,8]pentadecan-7-yl)-1-hydroxyethyl]-3,12,13,19-tetrahydroxy-23-(hydroxymethyl)-17-(2-hydroxypropylamino)heptacyclo[13.7.4.16,10.01,19.03,9.09,18.010,15]heptacosa-4,7,17-trien-24-yn-16-one
• 化学式: C₅₈H₈₃N₃O₁₂
• 分子量: 1014.3
• InChiKey: ZLQIJPJHZSOEAG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.8
• 重原子数：
  73
• 可旋转键数：
  12
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.78
• 拓扑面积：
  279
• 氢给体数：
  13
• 氢受体数：
  15