Glc3Me6S(b1-3)Glc6S(b1-4)[Xyl(b1-2)]Qui(b1-2)Xyl4S(b1-2)Glc3Me6S(b1-3)Glc6S(b1-4)[Xyl(b1-2)]Qui(b1-2)b-Xyl4S

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: Glc3Me6S(b1-3)Glc6S(b1-4)[Xyl(b1-2)]Qui(b1-2)Xyl4S(b1-2)Glc3Me6S(b1-3)Glc6S(b1-4)[Xyl(b1-2)]Qui(b1-2)b-Xyl4S
• 英文别名: [(3R,4R,5R,6S)-5-[(2S,3R,4S,5S,6R)-5-[(2S,3R,4S,5R,6R)-4-[(2S,3R,4S,5R,6R)-3,5-dihydroxy-4-methoxy-6-(sulfooxymethyl)oxan-2-yl]oxy-3,5-dihydroxy-6-(sulfooxymethyl)oxan-2-yl]oxy-4-hydroxy-6-methyl-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-6-[(2S,3R,4S,5R,6R)-2-[(2S,3R,4S,5R,6R)-2-[(2R,3S,4S,5R,6S)-6-[(2R,3R,4R,5R)-2,4-dihydroxy-5-sulfooxyoxan-3-yl]oxy-4-hydroxy-2-methyl-5-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(sulfooxymethyl)oxan-4-yl]oxy-5-hydroxy-4-methoxy-6-(sulfooxymethyl)oxan-3-yl]oxy-4-hydroxyoxan-3-yl] hydrogen sulfate
• 化学式: C₅₈H₉₈O₆₃S₆
• 分子量: 1995.8
• InChiKey: CYADJTIUTNWADH-OMEINPJOSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -19.1
• 重原子数：
  127
• 可旋转键数：
  36
• 环数：
  10.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  990
• 氢给体数：
  24
• 氢受体数：
  63