56-(Diaminomethyl)-50-(1,2-dihydroxyethyl)-13,21,53-trihydroxy-15-oxa-39,40-dithia-29-azaundecacyclo[43.4.3.24,42.234,37.14,42.110,14.118,22.01,46.03,44.023,35.026,30]nonapentaconta-5,10(59),11,13,18(58),19,21,26(30),27,34,36,56-dodecaen-32-yne-7,25-dione

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 56-(Diaminomethyl)-50-(1,2-dihydroxyethyl)-13,21,53-trihydroxy-15-oxa-39,40-dithia-29-azaundecacyclo[43.4.3.24,42.234,37.14,42.110,14.118,22.01,46.03,44.023,35.026,30]nonapentaconta-5,10(59),11,13,18(58),19,21,26(30),27,34,36,56-dodecaen-32-yne-7,25-dione
• 英文别名: 56-(diaminomethyl)-50-(1,2-dihydroxyethyl)-13,21,53-trihydroxy-15-oxa-39,40-dithia-29-azaundecacyclo[43.4.3.24,42.234,37.14,42.110,14.118,22.01,46.03,44.023,35.026,30]nonapentaconta-5,10(59),11,13,18(58),19,21,26(30),27,34,36,56-dodecaen-32-yne-7,25-dione
• 化学式: C₅₈H₆₇N₃O₈S₂
• 分子量: 998.3
• InChiKey: FLXDJURQBXYETA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7
• 重原子数：
  71
• 可旋转键数：
  3
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.52
• 拓扑面积：
  263
• 氢给体数：
  8
• 氢受体数：
  12