(2R,4R,5S,6R)-5-[(2R,3S,4R,5S,6R)-4-[(2R,3S,4S,5S,6S)-3-[(2R,3S,4S,5S,6R)-3-[(2S,3R,4R,5R,6R)-4-[(2S,3R,4R,5R,6S)-5-[(2S,3R,4R,5S,6R)-4-[[(4aR,6R,7R,8R,8aR)-7-[(2S,3S,5S,6S)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-2,8-dihydroxy-2-oxo-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3,2]dioxaphosphinin-6-yl]oxy]-3-acetamido-5-[(2S,3S,5S,6S)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-carboxy-3,4-dihydroxyoxan-2-yl]oxy-3-acetamido-5-hydroxy-6-methyloxan-2-yl]oxy-6-[(1S)-2-[(2S,3R,4R,5S,6R)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-hydroxyethyl]-4,5-dihydroxyoxan-2-yl]oxy-6-[(1S)-1-[(2S,3S,4S,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2-hydroxyethyl]-4,5-dihydroxyoxan-2-yl]oxy-5-[(2S,3R,4S,5S,6R)-6-[[(2S,3R,4R,5S)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-3-hydroxy-6-[(1S)-2-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyethyl]oxan-2-yl]oxy-6-[(1R)-1,2-dihydroxyethyl]-2-hydroxy-4-phosphonooxyoxane-2-carboxylic acid

• 分子结构分类: 有机化合物 - 有机聚合物 - 多糖
• 英文名称: (2R,4R,5S,6R)-5-[(2R,3S,4R,5S,6R)-4-[(2R,3S,4S,5S,6S)-3-[(2R,3S,4S,5S,6R)-3-[(2S,3R,4R,5R,6R)-4-[(2S,3R,4R,5R,6S)-5-[(2S,3R,4R,5S,6R)-4-[[(4aR,6R,7R,8R,8aR)-7-[(2S,3S,5S,6S)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-2,8-dihydroxy-2-oxo-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3,2]dioxaphosphinin-6-yl]oxy]-3-acetamido-5-[(2S,3S,5S,6S)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-carboxy-3,4-dihydroxyoxan-2-yl]oxy-3-acetamido-5-hydroxy-6-methyloxan-2-yl]oxy-6-[(1S)-2-[(2S,3R,4R,5S,6R)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-hydroxyethyl]-4,5-dihydroxyoxan-2-yl]oxy-6-[(1S)-1-[(2S,3S,4S,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2-hydroxyethyl]-4,5-dihydroxyoxan-2-yl]oxy-5-[(2S,3R,4S,5S,6R)-6-[[(2S,3R,4R,5S)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-3-hydroxy-6-[(1S)-2-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyethyl]oxan-2-yl]oxy-6-[(1R)-1,2-dihydroxyethyl]-2-hydroxy-4-phosphonooxyoxane-2-carboxylic acid
• 化学式: C₁₀₆H₁₇₇N₃O₈₇P₂
• 分子量: 2947.5
• InChiKey: XJKWNJAXSSTVEO-LSORCJSWSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -33.4
• 重原子数：
  198
• 可旋转键数：
  53
• 环数：
  17.0
• sp3杂化的碳原子比例：
  0.96
• 拓扑面积：
  1420
• 氢给体数：
  50
• 氢受体数：
  88