17-[14-(4-Amino-5-hydroxy-4,6-dimethyloxan-2-yl)oxy-2,8,12-trihydroxy-7,9,13-trimethylpentadecyl]-3-[4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-5-[4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-3,5-dihydroxy-6-methyloxan-2-yl]oxy-6-methyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1,7,9,13,23,25,27,33,34-nonahydroxy-4,14,18,24,30-pentamethyl-29-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-16,35-dioxabicyclo[29.3.1]pentatriaconta-11,19,21-trien-15-one

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 17-[14-(4-Amino-5-hydroxy-4,6-dimethyloxan-2-yl)oxy-2,8,12-trihydroxy-7,9,13-trimethylpentadecyl]-3-[4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-5-[4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-3,5-dihydroxy-6-methyloxan-2-yl]oxy-6-methyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1,7,9,13,23,25,27,33,34-nonahydroxy-4,14,18,24,30-pentamethyl-29-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-16,35-dioxabicyclo[29.3.1]pentatriaconta-11,19,21-trien-15-one
• 英文别名: 17-[14-(4-amino-5-hydroxy-4,6-dimethyloxan-2-yl)oxy-2,8,12-trihydroxy-7,9,13-trimethylpentadecyl]-3-[4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-5-[4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-3,5-dihydroxy-6-methyloxan-2-yl]oxy-6-methyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1,7,9,13,23,25,27,33,34-nonahydroxy-4,14,18,24,30-pentamethyl-29-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-16,35-dioxabicyclo[29.3.1]pentatriaconta-11,19,21-trien-15-one
• 化学式: C₉₉H₁₇₇N₃O₄₂
• 分子量: 2081.5
• InChiKey: NUOIELPDUUVKSA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -2.3
• 重原子数：
  144
• 可旋转键数：
  30
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.93
• 拓扑面积：
  749
• 氢给体数：
  28
• 氢受体数：
  45