81-(Diaminomethyl)-2,24,32,46-tetrahydroxy-66-(hydroxymethyl)spiro[30-oxa-5,6,69,70-tetrathia-16-azapentadecacyclo[50.18.5.28,11.12,41.13,41.123,27.131,35.010,22.015,19.042,72.044,58.046,54.047,51.057,67.060,65]henoctaconta-8,10,15(19),17,23,25,27(79),31,33,35(78),39,60,62,64,71,80-hexadecaen-12,74-diyne-50,1'-cyclopentane]-20,38-dione

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 81-(Diaminomethyl)-2,24,32,46-tetrahydroxy-66-(hydroxymethyl)spiro[30-oxa-5,6,69,70-tetrathia-16-azapentadecacyclo[50.18.5.28,11.12,41.13,41.123,27.131,35.010,22.015,19.042,72.044,58.046,54.047,51.057,67.060,65]henoctaconta-8,10,15(19),17,23,25,27(79),31,33,35(78),39,60,62,64,71,80-hexadecaen-12,74-diyne-50,1'-cyclopentane]-20,38-dione
• 英文别名: 81-(diaminomethyl)-2,24,32,46-tetrahydroxy-66-(hydroxymethyl)spiro[30-oxa-5,6,69,70-tetrathia-16-azapentadecacyclo[50.18.5.28,11.12,41.13,41.123,27.131,35.010,22.015,19.042,72.044,58.046,54.047,51.057,67.060,65]henoctaconta-8,10,15(19),17,23,25,27(79),31,33,35(78),39,60,62,64,71,80-hexadecaen-12,74-diyne-50,1'-cyclopentane]-20,38-dione
• 化学式: C₈₁H₉₁N₃O₈S₄
• 分子量: 1362.9
• InChiKey: ZAFKJDMEEVJPKL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11.9
• 重原子数：
  96
• 可旋转键数：
  2
• 环数：
  17.0
• sp3杂化的碳原子比例：
  0.53
• 拓扑面积：
  314
• 氢给体数：
  8
• 氢受体数：
  14