2-[3-[4-[5-[4-Amino-5-[5-[4-amino-5-[3,5-dihydroxy-6-methyl-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-4,6-dimethyloxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-4,6-dimethyloxan-2-yl]oxy-4-hydroxy-6-methyl-3-sulfooxyoxan-2-yl]oxy-3-hydroxyphenyl]prop-2-enoylamino]ethanesulfonic acid

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2-[3-[4-[5-[4-Amino-5-[5-[4-amino-5-[3,5-dihydroxy-6-methyl-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-4,6-dimethyloxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-4,6-dimethyloxan-2-yl]oxy-4-hydroxy-6-methyl-3-sulfooxyoxan-2-yl]oxy-3-hydroxyphenyl]prop-2-enoylamino]ethanesulfonic acid
• 英文别名: 2-[3-[4-[5-[4-amino-5-[5-[4-amino-5-[3,5-dihydroxy-6-methyl-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-4,6-dimethyloxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-4,6-dimethyloxan-2-yl]oxy-4-hydroxy-6-methyl-3-sulfooxyoxan-2-yl]oxy-3-hydroxyphenyl]prop-2-enoylamino]ethanesulfonic acid
• 化学式: C₄₉H₇₉N₃O₂₉S₂
• 分子量: 1238.3
• InChiKey: IUBKGMJMGLVZGT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -10.1
• 重原子数：
  83
• 可旋转键数：
  19
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.82
• 拓扑面积：
  509
• 氢给体数：
  14
• 氢受体数：
  31