2-[2-[34-Amino-13-[7-(ethylamino)-1,7-dihydroxy-10-methyl-6-methylideneundeca-2,4,9-trien-2-yl]-8,14,19,28-tetrahydroxy-4-methyl-3,32-dioxo-30,33-diazaheptacyclo[29.7.1.112,15.121,25.05,16.08,15.035,39]hentetraconta-1(39),4,21(40),22,24,35,37-heptaen-27-yl]-2-(4-hydroxyphenyl)ethyl]guanidine

• 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-[2-[34-Amino-13-[7-(ethylamino)-1,7-dihydroxy-10-methyl-6-methylideneundeca-2,4,9-trien-2-yl]-8,14,19,28-tetrahydroxy-4-methyl-3,32-dioxo-30,33-diazaheptacyclo[29.7.1.112,15.121,25.05,16.08,15.035,39]hentetraconta-1(39),4,21(40),22,24,35,37-heptaen-27-yl]-2-(4-hydroxyphenyl)ethyl]guanidine
• 英文别名: 2-[2-[34-amino-13-[7-(ethylamino)-1,7-dihydroxy-10-methyl-6-methylideneundeca-2,4,9-trien-2-yl]-8,14,19,28-tetrahydroxy-4-methyl-3,32-dioxo-30,33-diazaheptacyclo[29.7.1.112,15.121,25.05,16.08,15.035,39]hentetraconta-1(39),4,21(40),22,24,35,37-heptaen-27-yl]-2-(4-hydroxyphenyl)ethyl]guanidine
• 化学式: C₆₄H₈₇N₇O₉
• 分子量: 1098.4
• InChiKey: DEXMHZQRKQDIGA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  80
• 可旋转键数：
  13
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.52
• 拓扑面积：
  302
• 氢给体数：
  13
• 氢受体数：
  13