[17-(Diaminomethylideneamino)-29-ethyl-14-(hydroxymethyl)-5-(4-hydroxyphenyl)-9-(3-hydroxy-5-phenylpent-4-enoxy)-10-methoxy-4,12-dioxa-23,26-diaza-28-azanidaoctacyclo[20.15.2.216,19.132,36.02,11.03,8.021,26.027,31]dotetraconta-2,8,10,16,18,27(31),29,32,34,36(40),41-undecaen-38-yn-7-ylidene]oxidanium

• 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: [17-(Diaminomethylideneamino)-29-ethyl-14-(hydroxymethyl)-5-(4-hydroxyphenyl)-9-(3-hydroxy-5-phenylpent-4-enoxy)-10-methoxy-4,12-dioxa-23,26-diaza-28-azanidaoctacyclo[20.15.2.216,19.132,36.02,11.03,8.021,26.027,31]dotetraconta-2,8,10,16,18,27(31),29,32,34,36(40),41-undecaen-38-yn-7-ylidene]oxidanium
• 英文别名: [17-(diaminomethylideneamino)-29-ethyl-14-(hydroxymethyl)-5-(4-hydroxyphenyl)-9-(3-hydroxy-5-phenylpent-4-enoxy)-10-methoxy-4,12-dioxa-23,26-diaza-28-azanidaoctacyclo[20.15.2.216,19.132,36.02,11.03,8.021,26.027,31]dotetraconta-2,8,10,16,18,27(31),29,32,34,36(40),41-undecaen-38-yn-7-ylidene]oxidanium
• 化学式: C59H62N6O8
• 分子量: 983.2
• InChiKey: VBWYIINNJFCPNJ-UHFFFAOYSA-O

计算性质

• 辛醇/水分配系数(LogP)：
  7.3
• 重原子数：
  73
• 可旋转键数：
  11
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.32
• 拓扑面积：
  179
• 氢给体数：
  7
• 氢受体数：
  11