3-beta-O-{beta-D-glucopyranosyl-(1-> 3)-beta-D-glucopyranosyl-(1-> 3)-[beta-D-glucopyranosyl-(1-> 2)]-beta-D-glucopyranosyl-(1-> 4)-beta-D-galactopyranosyl}-2 alpha-hydroxyl-(25R)-5 alpha-spirostane.

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 类固醇和类固醇衍生物
• 英文名称: 3-beta-O-{beta-D-glucopyranosyl-(1-> 3)-beta-D-glucopyranosyl-(1-> 3)-[beta-D-glucopyranosyl-(1-> 2)]-beta-D-glucopyranosyl-(1-> 4)-beta-D-galactopyranosyl}-2 alpha-hydroxyl-(25R)-5 alpha-spirostane.
• 英文别名: 2-[2-[2-[4,5-dihydroxy-2-(hydroxymethyl)-6-[(6R,7S,9S,13S,15R,16R)-15-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl]oxyoxan-3-yl]oxy-5-hydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-4-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
• 化学式: C₅₇H₉₄O₂₉
• 分子量: 1243.3
• InChiKey: LHFLSIPWAUOODT-JEPXNDLPSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -3
• 重原子数：
  86
• 可旋转键数：
  15
• 环数：
  11.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  455
• 氢给体数：
  17
• 氢受体数：
  29