9,38-Diamino-2',4,21,26-tetrahydroxy-12-(4-hydroxyphenyl)-26,30-dimethyl-3'-(11-methyl-7-methylidene-1-oxacyclopentadeca-3,5,10-trien-13-yn-3-yl)spiro[2,8,10,39-tetrazahexacyclo[31.7.1.115,19.04,13.024,29.037,41]dotetraconta-8,15,17,19(42),29,33(41),34,36-octaen-6-yne-25,1'-cyclopentane]-31,40-dione

• 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: 9,38-Diamino-2',4,21,26-tetrahydroxy-12-(4-hydroxyphenyl)-26,30-dimethyl-3'-(11-methyl-7-methylidene-1-oxacyclopentadeca-3,5,10-trien-13-yn-3-yl)spiro[2,8,10,39-tetrazahexacyclo[31.7.1.115,19.04,13.024,29.037,41]dotetraconta-8,15,17,19(42),29,33(41),34,36-octaen-6-yne-25,1'-cyclopentane]-31,40-dione
• 英文别名: 9,38-diamino-2',4,21,26-tetrahydroxy-12-(4-hydroxyphenyl)-26,30-dimethyl-3'-(11-methyl-7-methylidene-1-oxacyclopentadeca-3,5,10-trien-13-yn-3-yl)spiro[2,8,10,39-tetrazahexacyclo[31.7.1.115,19.04,13.024,29.037,41]dotetraconta-8,15,17,19(42),29,33(41),34,36-octaen-6-yne-25,1'-cyclopentane]-31,40-dione
• 化学式: C₆₆H₈₀N₆O₈
• 分子量: 1085.4
• InChiKey: WGQRTYPXQMUYER-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  80
• 可旋转键数：
  2
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.47
• 拓扑面积：
  245
• 氢给体数：
  10
• 氢受体数：
  11