O1-[1-[2-[[(1S,6S)-2-[(R)-[(3R,4S,5R)-5-(aminomethyl)-3,4-dihydroxy-tetrahydrofuran-2-yl]oxy-[(3S,4R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl]-5-methoxycarbonyl-1,4-dimethyl-3-oxo-1,4-diazepan-6-yl]oxy]-2-oxo-ethyl]-12-methyl-tridecyl] O5-(3,4,5-trimethoxy-6-methyl-tetrahydropyran-2-yl) 3-methylpentanedioate

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: O1-[1-[2-[[(1S,6S)-2-[(R)-[(3R,4S,5R)-5-(aminomethyl)-3,4-dihydroxy-tetrahydrofuran-2-yl]oxy-[(3S,4R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl]-5-methoxycarbonyl-1,4-dimethyl-3-oxo-1,4-diazepan-6-yl]oxy]-2-oxo-ethyl]-12-methyl-tridecyl] O5-(3,4,5-trimethoxy-6-methyl-tetrahydropyran-2-yl) 3-methylpentanedioate
• 英文别名: 1-O-[1-[[(6S)-2-[(R)-[(3R,4S,5R)-5-(aminomethyl)-3,4-dihydroxyoxolan-2-yl]oxy-[(3S,4R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl]-5-methoxycarbonyl-1,4-dimethyl-3-oxo-1,4-diazepan-6-yl]oxy]-14-methyl-1-oxopentadecan-3-yl] 5-O-(3,4,5-trimethoxy-6-methyloxan-2-yl) 3-methylpentanedioate
• 化学式: C₅₄H₈₉N₅O₂₂
• 分子量: 1160.3
• InChiKey: MECMNHVGUVQLBZ-KTEXIAEJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  81
• 可旋转键数：
  34
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  350
• 氢给体数：
  6
• 氢受体数：
  24