1-[3-amino-4-[[1-[4-[3-carbamoyl-1-(2,5-dihydroxy-4-methoxy-3,6-dioxocyclohexa-1,4-dien-1-yl)-4,4,7-trihydroxy-2,5-dihydropyrazolo[3,4-c]pyridin-6-yl]phenyl]-6-oxopiperidin-3-yl]methoxy]-2-hydroxy-5,6-dioxocyclohexa-1,3-dien-1-yl]-6-[4-(3,3-dihydroxy-2-oxopiperidin-1-yl)phenyl]-4,4,7-trihydroxy-2,5-dihydropyrazolo[3,4-c]pyridine-3-carboxamide

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 哌啶类
• 英文名称: 1-[3-amino-4-[[1-[4-[3-carbamoyl-1-(2,5-dihydroxy-4-methoxy-3,6-dioxocyclohexa-1,4-dien-1-yl)-4,4,7-trihydroxy-2,5-dihydropyrazolo[3,4-c]pyridin-6-yl]phenyl]-6-oxopiperidin-3-yl]methoxy]-2-hydroxy-5,6-dioxocyclohexa-1,3-dien-1-yl]-6-[4-(3,3-dihydroxy-2-oxopiperidin-1-yl)phenyl]-4,4,7-trihydroxy-2,5-dihydropyrazolo[3,4-c]pyridine-3-carboxamide
• 化学式: C₅₀H₄₉N₁₁O₂₁
• 分子量: 1140.0
• InChiKey: GVRNFLWOZFVPAJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -4.7
• 重原子数：
  82
• 可旋转键数：
  12
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.28
• 拓扑面积：
  499
• 氢给体数：
  16
• 氢受体数：
  28