Hept(?1-2)Hept(?1-2)Hept(?1-2)Hept(?1-6)GlcN(a1-4)GalA(a1-3)[Hept(?1-7)]Hept(?1-3)[GalA(b1-6)Glc(b1-4)]Hept(?1-5)[Kdo(a2-4)Kdo(a2-4)]Kdo(a2-6)GlcN4P(b1-6)a-GlcN

• 分子结构分类: 有机化合物 - 有机聚合物 - 多糖
• 英文名称: Hept(?1-2)Hept(?1-2)Hept(?1-2)Hept(?1-6)GlcN(a1-4)GalA(a1-3)[Hept(?1-7)]Hept(?1-3)[GalA(b1-6)Glc(b1-4)]Hept(?1-5)[Kdo(a2-4)Kdo(a2-4)]Kdo(a2-6)GlcN4P(b1-6)a-GlcN
• 英文别名: (2R,4R,5R,6R)-2-[(2R,4R,5R,6R)-2-[(2R,4R,5R,6R)-2-[[(2R,3S,4R,5R,6R)-5-amino-6-[[(2R,3S,4R,5R,6S)-5-amino-3,4,6-trihydroxyoxan-2-yl]methoxy]-4-hydroxy-3-phosphonooxyoxan-2-yl]methoxy]-5-[4-[4-[(2S,3R,4R,5R,6S)-5-[(2R,3R,4R,5S,6R)-3-amino-6-[[6-(1,2-dihydroxyethyl)-3-[6-(1,2-dihydroxyethyl)-3-[6-(1,2-dihydroxyethyl)-3-[6-(1,2-dihydroxyethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]oxymethyl]-4,5-dihydroxyoxan-2-yl]oxy-6-carboxy-3,4-dihydroxyoxan-2-yl]oxy-6-[2-[6-(1,2-dihydroxyethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-1-hydroxyethyl]-3,5-dihydroxyoxan-2-yl]oxy-5-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4S,5R,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-6-(1,2-dihydroxyethyl)-3-hydroxyoxan-2-yl]oxy-2-carboxy-6-[(1R)-1,2-dihydroxyethyl]oxan-4-yl]oxy-2-carboxy-6-[(1R)-1,2-dihydroxyethyl]-5-hydroxyoxan-4-yl]oxy-6-[(1R)-1,2-dihydroxyethyl]-4,5-dihydroxyoxane-2-carboxylic acid
• 化学式: C₁₀₉H₁₈₂N₃O₉₆P
• 分子量: 3101.5
• InChiKey: DRRPJRRIQLXQCQ-BRXBGUOMSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -43.7
• 重原子数：
  209
• 可旋转键数：
  61
• 环数：
  16.0
• sp3杂化的碳原子比例：
  0.95
• 拓扑面积：
  1650
• 氢给体数：
  61
• 氢受体数：
  99