N-{(25S,11R,20R,21R)-6-[(1S,2S)-1,2-Dihydroxy-2-(4-hydroxy-3-iodophenyl)ethyl]-1,4,7,13,16,22-hexaaza-3-(2-carbamoyl-1-hydroxyethyl)-11,20,21,25-tetrahydroxy-15-(hydroxyethyl)-2,5,8,14,17,23-hexaoxotricyclo[22.3.0.0<9,13>]heptacos-18-yl}-10,12-dimethyltetradecanamide

• 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: N-{(25S,11R,20R,21R)-6-[(1S,2S)-1,2-Dihydroxy-2-(4-hydroxy-3-iodophenyl)ethyl]-1,4,7,13,16,22-hexaaza-3-(2-carbamoyl-1-hydroxyethyl)-11,20,21,25-tetrahydroxy-15-(hydroxyethyl)-2,5,8,14,17,23-hexaoxotricyclo[22.3.0.0<9,13>]heptacos-18-yl}-10,12-dimethyltetradecanamide
• 英文别名: N-[(3S,6S,9S,11R,15S,20R,21R,24S,25S)-3-[(1S)-3-amino-1-hydroxy-3-oxopropyl]-6-[(1S,2S)-1,2-dihydroxy-2-(4-hydroxy-3-iodophenyl)ethyl]-11,20,21,25-tetrahydroxy-15-[(1S)-1-hydroxyethyl]-2,5,8,14,17,23-hexaoxo-1,4,7,13,16,22-hexazatricyclo[22.3.0.09,13]heptacosan-18-yl]-10,12-dimethyltetradecanamide
• 化学式: C₅₀H₇₉IN₈O₁₇
• 分子量: 1191.1
• InChiKey: MJHHWVSCOREXCK-KNABUWEYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  76
• 可旋转键数：
  20
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.72
• 拓扑面积：
  411
• 氢给体数：
  15
• 氢受体数：
  17