1-[3-[4-[43-(Dihydroxymethyl)-9,41-dihydroxy-20-methoxy-12-methyl-26-oxo-33-phenyl-18,29-dioxa-3,4-dithiaoctacyclo[26.6.5.235,38.16,16.17,11.119,23.08,32.015,44]tetratetraconta-6(43),7(44),8,10,13,15,19,21,23(42),35,40-undecaen-30-yn-37-yl]butyl]phenyl]-2-methylguanidine

• 分子结构分类: 有机化合物 - 苯类化合物 - 非那烯类
• 英文名称: 1-[3-[4-[43-(Dihydroxymethyl)-9,41-dihydroxy-20-methoxy-12-methyl-26-oxo-33-phenyl-18,29-dioxa-3,4-dithiaoctacyclo[26.6.5.235,38.16,16.17,11.119,23.08,32.015,44]tetratetraconta-6(43),7(44),8,10,13,15,19,21,23(42),35,40-undecaen-30-yn-37-yl]butyl]phenyl]-2-methylguanidine
• 英文别名: 1-[3-[4-[43-(dihydroxymethyl)-9,41-dihydroxy-20-methoxy-12-methyl-26-oxo-33-phenyl-18,29-dioxa-3,4-dithiaoctacyclo[26.6.5.235,38.16,16.17,11.119,23.08,32.015,44]tetratetraconta-6(43),7(44),8,10,13,15,19,21,23(42),35,40-undecaen-30-yn-37-yl]butyl]phenyl]-2-methylguanidine
• 化学式: C₆₁H₆₅N₃O₈S₂
• 分子量: 1032.3
• InChiKey: JYJZHMHOXJRGJT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.7
• 重原子数：
  74
• 可旋转键数：
  10
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  227
• 氢给体数：
  6
• 氢受体数：
  11