[6-Acetyloxy-10,16,29-trihydroxy-11-[[7-hydroxy-2-[(4-hydroxyphenyl)methyl]-4-methylheptyl]amino]-25-[1-(hydroxymethyl)cyclopentyl]-16-methylspiro[27-oxa-13,14-dithiapentacyclo[22.7.1.02,22.07,18.028,32]dotriaconta-1(32),28,30-trien-20-yne-3,4'-piperidine]-4-yl] 2-oxo-1,3,4,4a,5,6,7,8-octahydroquinoline-8a-carboxylate

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: [6-Acetyloxy-10,16,29-trihydroxy-11-[[7-hydroxy-2-[(4-hydroxyphenyl)methyl]-4-methylheptyl]amino]-25-[1-(hydroxymethyl)cyclopentyl]-16-methylspiro[27-oxa-13,14-dithiapentacyclo[22.7.1.02,22.07,18.028,32]dotriaconta-1(32),28,30-trien-20-yne-3,4'-piperidine]-4-yl] 2-oxo-1,3,4,4a,5,6,7,8-octahydroquinoline-8a-carboxylate
• 英文别名: [6-acetyloxy-10,16,29-trihydroxy-11-[[7-hydroxy-2-[(4-hydroxyphenyl)methyl]-4-methylheptyl]amino]-25-[1-(hydroxymethyl)cyclopentyl]-16-methylspiro[27-oxa-13,14-dithiapentacyclo[22.7.1.02,22.07,18.028,32]dotriaconta-1(32),28,30-trien-20-yne-3,4'-piperidine]-4-yl] 2-oxo-1,3,4,4a,5,6,7,8-octahydroquinoline-8a-carboxylate
• 化学式: C₆₇H₉₇N₃O₁₂S₂
• 分子量: 1200.6
• InChiKey: MVJZNHDMBZAGOA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.6
• 重原子数：
  84
• 可旋转键数：
  17
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  287
• 氢给体数：
  9
• 氢受体数：
  16