16-[[3-[2-[3-Amino-5-(2-methylpropyl)phenyl]cyclopentyl]-3-methyloxiran-2-yl]-hydroxymethyl]-5,36-dihydroxy-12-(hydroxymethyl)-41-[3-hydroxy-5-(methylaminomethyl)phenyl]-21,26,36-trimethyl-38-azaundecacyclo[29.7.4.11,26.14,8.19,13.03,21.03,25.018,22.027,41.017,44.031,43]pentatetraconta-6,14,18(22),28-tetraene-19,42-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: 16-[[3-[2-[3-Amino-5-(2-methylpropyl)phenyl]cyclopentyl]-3-methyloxiran-2-yl]-hydroxymethyl]-5,36-dihydroxy-12-(hydroxymethyl)-41-[3-hydroxy-5-(methylaminomethyl)phenyl]-21,26,36-trimethyl-38-azaundecacyclo[29.7.4.11,26.14,8.19,13.03,21.03,25.018,22.027,41.017,44.031,43]pentatetraconta-6,14,18(22),28-tetraene-19,42-dione
• 英文别名: 16-[[3-[2-[3-amino-5-(2-methylpropyl)phenyl]cyclopentyl]-3-methyloxiran-2-yl]-hydroxymethyl]-5,36-dihydroxy-12-(hydroxymethyl)-41-[3-hydroxy-5-(methylaminomethyl)phenyl]-21,26,36-trimethyl-38-azaundecacyclo[29.7.4.11,26.14,8.19,13.03,21.03,25.018,22.027,41.017,44.031,43]pentatetraconta-6,14,18(22),28-tetraene-19,42-dione
• 化学式: C₇₅H₁₀₁N₃O₈
• 分子量: 1172.6
• InChiKey: JSZXNWRKZJMMRU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.3
• 重原子数：
  86
• 可旋转键数：
  10
• 环数：
  17.0
• sp3杂化的碳原子比例：
  0.71
• 拓扑面积：
  198
• 氢给体数：
  8
• 氢受体数：
  11