5-(4-Amino-9,19-dihydroxyspiro[16,23-dioxa-36,37-dithia-3,25,29-triazanonacyclo[19.13.4.25,8.125,28.01,6.07,32.012,24.017,22.027,31]hentetraconta-5,7,17(22),18,20,26,28(39),30,33,40-decaen-10,14-diyne-13,1'-cyclopentane]-20-yl)-1-hydroxy-1-(3-hydroxy-2,3,4,4a,4b,5,6,7,8,8a-decahydrophenanthren-2-yl)pentan-3-one

• 分子结构分类: 有机化合物 - 苯类化合物 - 菲及其衍生物
• 英文名称: 5-(4-Amino-9,19-dihydroxyspiro[16,23-dioxa-36,37-dithia-3,25,29-triazanonacyclo[19.13.4.25,8.125,28.01,6.07,32.012,24.017,22.027,31]hentetraconta-5,7,17(22),18,20,26,28(39),30,33,40-decaen-10,14-diyne-13,1'-cyclopentane]-20-yl)-1-hydroxy-1-(3-hydroxy-2,3,4,4a,4b,5,6,7,8,8a-decahydrophenanthren-2-yl)pentan-3-one
• 英文别名: 5-(4-amino-9,19-dihydroxyspiro[16,23-dioxa-36,37-dithia-3,25,29-triazanonacyclo[19.13.4.25,8.125,28.01,6.07,32.012,24.017,22.027,31]hentetraconta-5,7,17(22),18,20,26,28(39),30,33,40-decaen-10,14-diyne-13,1'-cyclopentane]-20-yl)-1-hydroxy-1-(3-hydroxy-2,3,4,4a,4b,5,6,7,8,8a-decahydrophenanthren-2-yl)pentan-3-one
• 化学式: C₅₇H₆₀N₄O₇S₂
• 分子量: 977.2
• InChiKey: FLFCQVQDVAJEAY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.4
• 重原子数：
  70
• 可旋转键数：
  6
• 环数：
  15.0
• sp3杂化的碳原子比例：
  0.49
• 拓扑面积：
  226
• 氢给体数：
  7
• 氢受体数：
  11