[5-[[3,4-Dihydroxy-6-(hydroxymethyl)-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxymethyl]-2,3,4-trihydroxycyclohexyl] 10,11-dihydroxy-9-(hydroxymethyl)-1,2,6,6a,6b,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,7,8,8a,10,11,12,13,14b-hexadecahydropicene-4-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: [5-[[3,4-Dihydroxy-6-(hydroxymethyl)-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxymethyl]-2,3,4-trihydroxycyclohexyl] 10,11-dihydroxy-9-(hydroxymethyl)-1,2,6,6a,6b,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,7,8,8a,10,11,12,13,14b-hexadecahydropicene-4-carboxylate
• 英文别名: [5-[[3,4-dihydroxy-6-(hydroxymethyl)-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxymethyl]-2,3,4-trihydroxycyclohexyl] 10,11-dihydroxy-9-(hydroxymethyl)-1,2,6,6a,6b,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,7,8,8a,10,11,12,13,14b-hexadecahydropicene-4-carboxylate
• 化学式: C₅₀H₈₂O₁₈
• 分子量: 971.2
• InChiKey: YVKBRGWBLOSUFH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1
• 重原子数：
  68
• 可旋转键数：
  10
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.94
• 拓扑面积：
  306
• 氢给体数：
  12
• 氢受体数：
  18