58-(Diaminomethyl)-3,11,25,51-tetrahydroxy-45-(hydroxymethyl)spiro[9-oxa-48,49,54,55-tetrathia-65-azatridecacyclo[55.13.2.12,6.110,14.120,51.120,52.023,37.025,33.026,30.036,46.039,44.060,71.064,68]hexaheptaconta-2,4,6(76),10,12,14(75),18,39,41,43,57(72),58,60(71),64(68),66-pentadecaen-61-yne-29,1'-cyclopentane]-17,69-dione

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 58-(Diaminomethyl)-3,11,25,51-tetrahydroxy-45-(hydroxymethyl)spiro[9-oxa-48,49,54,55-tetrathia-65-azatridecacyclo[55.13.2.12,6.110,14.120,51.120,52.023,37.025,33.026,30.036,46.039,44.060,71.064,68]hexaheptaconta-2,4,6(76),10,12,14(75),18,39,41,43,57(72),58,60(71),64(68),66-pentadecaen-61-yne-29,1'-cyclopentane]-17,69-dione
• 英文别名: 58-(diaminomethyl)-3,11,25,51-tetrahydroxy-45-(hydroxymethyl)spiro[9-oxa-48,49,54,55-tetrathia-65-azatridecacyclo[55.13.2.12,6.110,14.120,51.120,52.023,37.025,33.026,30.036,46.039,44.060,71.064,68]hexaheptaconta-2,4,6(76),10,12,14(75),18,39,41,43,57(72),58,60(71),64(68),66-pentadecaen-61-yne-29,1'-cyclopentane]-17,69-dione
• 化学式: C₇₆H₉₁N₃O₈S₄
• 分子量: 1302.8
• InChiKey: OTHWOAHZOBZPBJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.4
• 重原子数：
  91
• 可旋转键数：
  2
• 环数：
  14.0
• sp3杂化的碳原子比例：
  0.55
• 拓扑面积：
  314
• 氢给体数：
  8
• 氢受体数：
  14