11,19',23',29',44',50'-Hexahydroxy-36',50'-bis(hydroxymethyl)-18-methoxy-12'-methyl-19'-[3-(3-methylbutan-2-yl)oxiran-2-yl]spiro[21-azapentacyclo[11.7.1.11,4.08,12.015,20]docos-16-en-6-yne-10,34'-4-oxa-42,43-dithia-32-azaundecacyclo[21.21.3.13,11.127,31.132,35.01,12.07,11.013,47.015,24.020,24.035,40]pentaconta-16,27(49),28,30,46-pentaene]-45',48'-dione

• 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: 11,19',23',29',44',50'-Hexahydroxy-36',50'-bis(hydroxymethyl)-18-methoxy-12'-methyl-19'-[3-(3-methylbutan-2-yl)oxiran-2-yl]spiro[21-azapentacyclo[11.7.1.11,4.08,12.015,20]docos-16-en-6-yne-10,34'-4-oxa-42,43-dithia-32-azaundecacyclo[21.21.3.13,11.127,31.132,35.01,12.07,11.013,47.015,24.020,24.035,40]pentaconta-16,27(49),28,30,46-pentaene]-45',48'-dione
• 英文别名: 11,19',23',29',44',50'-hexahydroxy-36',50'-bis(hydroxymethyl)-18-methoxy-12'-methyl-19'-[3-(3-methylbutan-2-yl)oxiran-2-yl]spiro[21-azapentacyclo[11.7.1.11,4.08,12.015,20]docos-16-en-6-yne-10,34'-4-oxa-42,43-dithia-32-azaundecacyclo[21.21.3.13,11.127,31.132,35.01,12.07,11.013,47.015,24.020,24.035,40]pentaconta-16,27(49),28,30,46-pentaene]-45',48'-dione
• 化学式: C₇₇H₁₀₄N₂O₁₃S₂
• 分子量: 1329.8
• InChiKey: DZQWPDDDGFHZHP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.7
• 重原子数：
  94
• 可旋转键数：
  6
• 环数：
  19.0
• sp3杂化的碳原子比例：
  0.79
• 拓扑面积：
  293
• 氢给体数：
  9
• 氢受体数：
  16