Gal3P(b1-4)[Gal3P(b1-6)]LDManHep(a1-6)Glc(b1-4)[LDManHep(a1-2)LDManHep(a1-3)]LDManHep(a1-5)[Kdo(a2-4)]a-Kdo

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: Gal3P(b1-4)[Gal3P(b1-6)]LDManHep(a1-6)Glc(b1-4)[LDManHep(a1-2)LDManHep(a1-3)]LDManHep(a1-5)[Kdo(a2-4)]a-Kdo
• 英文别名: (2R,4R,5R,6R)-2-[(2R,4R,5R,6R)-2-carboxy-6-[(1R)-1,2-dihydroxyethyl]-5-[(2R,3S,4R,5R,6R)-6-[(1S)-1,2-dihydroxyethyl]-4-[(2R,3S,4S,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3-[(2R,3S,4S,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]oxy-5-[(2S,3R,4S,5S,6R)-6-[[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5S,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-phosphonooxyoxan-2-yl]oxy-6-[(1S)-1-[(2S,3R,4S,5S,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-phosphonooxyoxan-2-yl]oxy-2-hydroxyethyl]-3,4-dihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-3-hydroxyoxan-2-yl]oxy-2-hydroxyoxan-4-yl]oxy-6-[(1R)-1,2-dihydroxyethyl]-4,5-dihydroxyoxane-2-carboxylic acid
• 化学式: C₆₂H₁₀₆O₆₀P₂
• 分子量: 1873.4
• InChiKey: HPXHEHJJEKSJOC-YARLLCCLSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -22.7
• 重原子数：
  124
• 可旋转键数：
  37
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.97
• 拓扑面积：
  992
• 氢给体数：
  37
• 氢受体数：
  60