51-Acetyl-10-benzyl-15,20,21,38-tetrahydroxy-11-[4-hydroxy-2-(hydroxymethyl)-5-methoxyphenyl]-5-azapentadecacyclo[37.15.2.112,45.141,49.02,27.04,17.07,16.014,44.017,26.018,23.024,29.027,35.029,33.036,55.043,48]octapentaconta-1(55),18,20,22,34,39(56),41(57),42,46,48-decaen-8,53-diyn-13-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: 51-Acetyl-10-benzyl-15,20,21,38-tetrahydroxy-11-[4-hydroxy-2-(hydroxymethyl)-5-methoxyphenyl]-5-azapentadecacyclo[37.15.2.112,45.141,49.02,27.04,17.07,16.014,44.017,26.018,23.024,29.027,35.029,33.036,55.043,48]octapentaconta-1(55),18,20,22,34,39(56),41(57),42,46,48-decaen-8,53-diyn-13-one
• 英文别名: 51-acetyl-10-benzyl-15,20,21,38-tetrahydroxy-11-[4-hydroxy-2-(hydroxymethyl)-5-methoxyphenyl]-5-azapentadecacyclo[37.15.2.112,45.141,49.02,27.04,17.07,16.014,44.017,26.018,23.024,29.027,35.029,33.036,55.043,48]octapentaconta-1(55),18,20,22,34,39(56),41(57),42,46,48-decaen-8,53-diyn-13-one
• 化学式: C₇₄H₇₃NO₉
• 分子量: 1120.4
• InChiKey: ZTVNLQVSOQIANZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8
• 重原子数：
  84
• 可旋转键数：
  6
• 环数：
  16.0
• sp3杂化的碳原子比例：
  0.49
• 拓扑面积：
  177
• 氢给体数：
  7
• 氢受体数：
  10