(2S,3R,5R)-2-[5-butyl-2-[[(2S,3R,5R)-3,4-dihydroxy-6-(hydroxymethyl)-5-methyloxan-2-yl]oxymethyl]-5-phenylnonoxy]-6-(hydroxymethyl)oxane-3,4,5-triol;(2S,3R,5R)-2-[(3R,5R,6S)-6-[2-[[(2S,3R,5R)-5-[(2S,3R,5R)-3,4-dihydroxy-6-(hydroxymethyl)-5-methyloxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-heptyl-5-phenyldodecoxy]-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;(2S,3R,5R)-2-[(3R,5R,6S)-6-[2-[[(2S,3R,5R)-5-[(2S,3R,5R)-3,4-dihydroxy-6-(hydroxymethyl)-5-methyloxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hexyl-5-phenylundecoxy]-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: (2S,3R,5R)-2-[5-butyl-2-[[(2S,3R,5R)-3,4-dihydroxy-6-(hydroxymethyl)-5-methyloxan-2-yl]oxymethyl]-5-phenylnonoxy]-6-(hydroxymethyl)oxane-3,4,5-triol;(2S,3R,5R)-2-[(3R,5R,6S)-6-[2-[[(2S,3R,5R)-5-[(2S,3R,5R)-3,4-dihydroxy-6-(hydroxymethyl)-5-methyloxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-heptyl-5-phenyldodecoxy]-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;(2S,3R,5R)-2-[(3R,5R,6S)-6-[2-[[(2S,3R,5R)-5-[(2S,3R,5R)-3,4-dihydroxy-6-(hydroxymethyl)-5-methyloxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hexyl-5-phenylundecoxy]-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
• 化学式: C133H228O53
• 分子量: 2675.2
• InChiKey: AFMKWOHQSIKQNQ-NZCHIQNMSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.03
• 重原子数：
  186
• 可旋转键数：
  76
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.86
• 拓扑面积：
  852
• 氢给体数：
  33
• 氢受体数：
  53