[6-Acetyloxy-10,16,29-trihydroxy-25-[1-(hydroxymethyl)cyclopentyl]-11-[[9-(4-hydroxyphenyl)-4-piperazin-1-ylspiro[5.5]undec-2-en-10-yl]methylamino]-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 - 苯类化合物 - 苯和取代衍生物
• 英文名称: [6-Acetyloxy-10,16,29-trihydroxy-25-[1-(hydroxymethyl)cyclopentyl]-11-[[9-(4-hydroxyphenyl)-4-piperazin-1-ylspiro[5.5]undec-2-en-10-yl]methylamino]-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-25-[1-(hydroxymethyl)cyclopentyl]-11-[[9-(4-hydroxyphenyl)-4-piperazin-1-ylspiro[5.5]undec-2-en-10-yl]methylamino]-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: C₇₄H₁₀₅N₅O₁₁S₂
• 分子量: 1304.8
• InChiKey: BFJXFKTZFBAVNT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9
• 重原子数：
  92
• 可旋转键数：
  12
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.74
• 拓扑面积：
  282
• 氢给体数：
  9
• 氢受体数：
  17