[4,5-dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxan-2-yl] 4a,4b,7,7,10a-pentamethyl-2-(3-methyl-4-oxopentyl)-8-(3,4,5-trihydroxyoxan-2-yl)oxy-4,5,6,6a,8,9,10,10b-octahydro-3H-chrysene-2-carboxylate

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: [4,5-dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxan-2-yl] 4a,4b,7,7,10a-pentamethyl-2-(3-methyl-4-oxopentyl)-8-(3,4,5-trihydroxyoxan-2-yl)oxy-4,5,6,6a,8,9,10,10b-octahydro-3H-chrysene-2-carboxylate
• 化学式: C₅₂H₈₂O₂₁
• 分子量: 1043.2
• InChiKey: ZTSXUYAKTQNLIO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.2
• 重原子数：
  73
• 可旋转键数：
  14
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  331
• 氢给体数：
  11
• 氢受体数：
  21