17-[(2-Amino-1,2-dihydropyridin-5-yl)methyl]-30-(cyclohexylmethylamino)-25-[2-(hydroxymethyl)-3-methyl-4-[11-(methylamino)-2,12-diazatricyclo[7.3.1.05,13]trideca-1(13),4-dien-6-yl]but-2-enyl]-4-(3-hydroxypropyl)-17-methyl-3,26-dioxahexacyclo[17.7.2.25,8.01,25.07,12.023,28]triaconta-8(29),9,19(28),20,22-pentaene-2,24,27-trione

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: 17-[(2-Amino-1,2-dihydropyridin-5-yl)methyl]-30-(cyclohexylmethylamino)-25-[2-(hydroxymethyl)-3-methyl-4-[11-(methylamino)-2,12-diazatricyclo[7.3.1.05,13]trideca-1(13),4-dien-6-yl]but-2-enyl]-4-(3-hydroxypropyl)-17-methyl-3,26-dioxahexacyclo[17.7.2.25,8.01,25.07,12.023,28]triaconta-8(29),9,19(28),20,22-pentaene-2,24,27-trione
• 英文别名: 17-[(2-amino-1,2-dihydropyridin-5-yl)methyl]-30-(cyclohexylmethylamino)-25-[2-(hydroxymethyl)-3-methyl-4-[11-(methylamino)-2,12-diazatricyclo[7.3.1.05,13]trideca-1(13),4-dien-6-yl]but-2-enyl]-4-(3-hydroxypropyl)-17-methyl-3,26-dioxahexacyclo[17.7.2.25,8.01,25.07,12.023,28]triaconta-8(29),9,19(28),20,22-pentaene-2,24,27-trione
• 化学式: C₆₃H₈₆N₆O₇
• 分子量: 1039.4
• InChiKey: MXBSAAVTGIUDPR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.6
• 重原子数：
  76
• 可旋转键数：
  14
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.63
• 拓扑面积：
  200
• 氢给体数：
  8
• 氢受体数：
  13