[20-Amino-15-[3-[2-(diaminomethylideneamino)ethoxy]-4,4,5-trihydroxy-6-methyloxan-2-yl]oxy-14-[[3-formyl-1-hydroxy-13-(methylaminomethyl)-4-tetracyclo[6.6.2.02,7.011,15]hexadeca-2(7),3,5-trienyl]methyl]-13,23-dihydroxy-7-(hydroxymethyl)-10,30-dioxo-5-pentacyclo[23.3.1.18,12.04,9.011,16]triaconta-1(28),2,4,6,8,11(16),12,14,25(29),26-decaen-18-ynyl] acetate

• 分子结构分类: 有机化合物 - 苯类化合物 - 蒽
• 英文名称: [20-Amino-15-[3-[2-(diaminomethylideneamino)ethoxy]-4,4,5-trihydroxy-6-methyloxan-2-yl]oxy-14-[[3-formyl-1-hydroxy-13-(methylaminomethyl)-4-tetracyclo[6.6.2.02,7.011,15]hexadeca-2(7),3,5-trienyl]methyl]-13,23-dihydroxy-7-(hydroxymethyl)-10,30-dioxo-5-pentacyclo[23.3.1.18,12.04,9.011,16]triaconta-1(28),2,4,6,8,11(16),12,14,25(29),26-decaen-18-ynyl] acetate
• 英文别名: [20-amino-15-[3-[2-(diaminomethylideneamino)ethoxy]-4,4,5-trihydroxy-6-methyloxan-2-yl]oxy-14-[[3-formyl-1-hydroxy-13-(methylaminomethyl)-4-tetracyclo[6.6.2.02,7.011,15]hexadeca-2(7),3,5-trienyl]methyl]-13,23-dihydroxy-7-(hydroxymethyl)-10,30-dioxo-5-pentacyclo[23.3.1.18,12.04,9.011,16]triaconta-1(28),2,4,6,8,11(16),12,14,25(29),26-decaen-18-ynyl] acetate
• 化学式: C₆₂H₇₁N₅O₁₅
• 分子量: 1126.2
• InChiKey: PCKHGDXPCKQKRP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  82
• 可旋转键数：
  14
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.47
• 拓扑面积：
  349
• 氢给体数：
  11
• 氢受体数：
  18