methyl 2-[[(5S,6S)-6,9,14-trihydroxy-5-[3-hydroxy-6-methyl-5-(methylamino)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-11-methoxy-3-methyl-8,13-dioxo-1-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-5,6-dihydrobenzo[a]tetracene-2-carbonyl]amino]propanoate

• 分子结构分类: 有机化合物 - 苯类化合物 - 并四苯
• 英文名称: methyl 2-[[(5S,6S)-6,9,14-trihydroxy-5-[3-hydroxy-6-methyl-5-(methylamino)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-11-methoxy-3-methyl-8,13-dioxo-1-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-5,6-dihydrobenzo[a]tetracene-2-carbonyl]amino]propanoate
• 英文别名: methyl 2-[[(5S,6S)-6,9,14-trihydroxy-5-[3-hydroxy-6-methyl-5-(methylamino)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-11-methoxy-3-methyl-8,13-dioxo-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,6-dihydrobenzo[a]tetracene-2-carbonyl]amino]propanoate
• 化学式: C₄₈H₅₈N₂O₂₄
• 分子量: 1047.0
• InChiKey: GEVZBVLELYQHNZ-ATRYFWBFSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.7
• 重原子数：
  74
• 可旋转键数：
  14
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  409
• 氢给体数：
  14
• 氢受体数：
  25