2-Hydroxy-2-[20,24,28,30-tetrahydroxy-18-[2-hydroxy-1-[[3,7,11,13-tetrahydroxy-12-[(7-hydroxy-4,4,6,8-tetramethyl-5-oxonon-2-enoyl)amino]-6,8,10,14-tetramethylpentadec-8-enoyl]amino]propyl]-2,35-dimethoxy-25,27,29,34-tetramethyl-13,16-dioxo-17,36-dioxa-14-azabicyclo[30.3.1]hexatriaconta-3,5,7,9,11,22,26-heptaen-15-yl]acetic acid

• 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: 2-Hydroxy-2-[20,24,28,30-tetrahydroxy-18-[2-hydroxy-1-[[3,7,11,13-tetrahydroxy-12-[(7-hydroxy-4,4,6,8-tetramethyl-5-oxonon-2-enoyl)amino]-6,8,10,14-tetramethylpentadec-8-enoyl]amino]propyl]-2,35-dimethoxy-25,27,29,34-tetramethyl-13,16-dioxo-17,36-dioxa-14-azabicyclo[30.3.1]hexatriaconta-3,5,7,9,11,22,26-heptaen-15-yl]acetic acid
• 英文别名: 2-hydroxy-2-[20,24,28,30-tetrahydroxy-18-[2-hydroxy-1-[[3,7,11,13-tetrahydroxy-12-[(7-hydroxy-4,4,6,8-tetramethyl-5-oxonon-2-enoyl)amino]-6,8,10,14-tetramethylpentadec-8-enoyl]amino]propyl]-2,35-dimethoxy-25,27,29,34-tetramethyl-13,16-dioxo-17,36-dioxa-14-azabicyclo[30.3.1]hexatriaconta-3,5,7,9,11,22,26-heptaen-15-yl]acetic acid
• 化学式: C₇₆H₁₂₃N₃O₂₂
• 分子量: 1430.8
• InChiKey: ALHCXBJQORVIJW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.8
• 重原子数：
  101
• 可旋转键数：
  26
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.68
• 拓扑面积：
  418
• 氢给体数：
  15
• 氢受体数：
  22