30-Amino-25-[2-[4-hydroxy-3-[(3-hydroxyphenyl)methyl]phenyl]ethyl]-7-(12-oxatetracyclo[6.6.2.02,7.011,15]hexadeca-2,4,6-trien-1-yl)-11,34-dioxa-2,31-diazahexacyclo[19.10.3.12,5.112,16.04,9.028,32]hexatriaconta-1(32),3,5(36),6,8,12,14,16(35),28-nonaen-26-yne-13,19-diol

• 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: 30-Amino-25-[2-[4-hydroxy-3-[(3-hydroxyphenyl)methyl]phenyl]ethyl]-7-(12-oxatetracyclo[6.6.2.02,7.011,15]hexadeca-2,4,6-trien-1-yl)-11,34-dioxa-2,31-diazahexacyclo[19.10.3.12,5.112,16.04,9.028,32]hexatriaconta-1(32),3,5(36),6,8,12,14,16(35),28-nonaen-26-yne-13,19-diol
• 英文别名: 30-amino-25-[2-[4-hydroxy-3-[(3-hydroxyphenyl)methyl]phenyl]ethyl]-7-(12-oxatetracyclo[6.6.2.02,7.011,15]hexadeca-2,4,6-trien-1-yl)-11,34-dioxa-2,31-diazahexacyclo[19.10.3.12,5.112,16.04,9.028,32]hexatriaconta-1(32),3,5(36),6,8,12,14,16(35),28-nonaen-26-yne-13,19-diol
• 化学式: C₆₂H₆₅N₃O₇
• 分子量: 964.2
• InChiKey: CUGUCNNFFYVMDF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.1
• 重原子数：
  72
• 可旋转键数：
  6
• 环数：
  12.0
• sp3杂化的碳原子比例：
  0.39
• 拓扑面积：
  152
• 氢给体数：
  6
• 氢受体数：
  9