34-Benzyl-8,25,26,54-tetrahydroxy-35-[4-hydroxy-2-(hydroxymethyl)-5-methoxyphenyl]-46-(hydroxymethyl)-51-azatetradecacyclo[28.21.3.17,42.01,29.03,19.05,10.011,19.013,17.017,22.020,29.023,28.031,50.038,54.040,45]pentapentaconta-4,6,11,23,25,27,40(45),41,43-nonaen-32,47-diyn-37-one

• 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: 34-Benzyl-8,25,26,54-tetrahydroxy-35-[4-hydroxy-2-(hydroxymethyl)-5-methoxyphenyl]-46-(hydroxymethyl)-51-azatetradecacyclo[28.21.3.17,42.01,29.03,19.05,10.011,19.013,17.017,22.020,29.023,28.031,50.038,54.040,45]pentapentaconta-4,6,11,23,25,27,40(45),41,43-nonaen-32,47-diyn-37-one
• 英文别名: 34-benzyl-8,25,26,54-tetrahydroxy-35-[4-hydroxy-2-(hydroxymethyl)-5-methoxyphenyl]-46-(hydroxymethyl)-51-azatetradecacyclo[28.21.3.17,42.01,29.03,19.05,10.011,19.013,17.017,22.020,29.023,28.031,50.038,54.040,45]pentapentaconta-4,6,11,23,25,27,40(45),41,43-nonaen-32,47-diyn-37-one
• 化学式: C₇₀H₇₁NO₉
• 分子量: 1070.3
• InChiKey: IIEBETKXVNEBAM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.6
• 重原子数：
  80
• 可旋转键数：
  6
• 环数：
  20.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  180
• 氢给体数：
  8
• 氢受体数：
  10