Fuc3Me(a1-2)Xyl3Me(b1-4)[GalNAc3Me(a1-3)]Fuc(a1-4)GlcNAc(b1-2)Man(a1-3)[Xyl(b1-2)]Man(b1-4)b-Glc

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: Fuc3Me(a1-2)Xyl3Me(b1-4)[GalNAc3Me(a1-3)]Fuc(a1-4)GlcNAc(b1-2)Man(a1-3)[Xyl(b1-2)]Man(b1-4)b-Glc
• 英文别名: N-[(2S,3R,4R,5S,6R)-5-[(2S,3S,4S,5R,6S)-4-[(2R,3R,4R,5R,6R)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-methoxyoxan-2-yl]oxy-5-[(2S,3R,4S,5R)-3-[(2S,3S,4R,5R,6S)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-5-hydroxy-4-methoxyoxan-2-yl]oxy-3-hydroxy-6-methyloxan-2-yl]oxy-2-[(2R,3S,4S,5S,6R)-4,5-dihydroxy-2-[(2R,3R,4S,5S,6S)-3-hydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-5-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-4-yl]oxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
• 化学式: C₅₉H₁₀₀N₂O₄₂
• 分子量: 1509.4
• InChiKey: YPYLDJDXXFPKMG-CDYVZUJNSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -13.7
• 重原子数：
  103
• 可旋转键数：
  26
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.97
• 拓扑面积：
  647
• 氢给体数：
  22
• 氢受体数：
  42