70-(Diaminomethyl)-11,19,41,60-tetrahydroxy-47-(hydroxymethyl)-60-methyl-13-oxa-37,38,43,44-tetrathia-27-azatridecacyclo[40.21.2.232,35.256,62.12,40.12,41.18,12.116,20.021,33.024,28.046,56.048,53.055,62]triheptaconta-3,8(73),9,11,16(72),17,19,24(28),25,32,34,48,50,52,64,66,70-heptadecaen-30-yne-5,23-dione

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 70-(Diaminomethyl)-11,19,41,60-tetrahydroxy-47-(hydroxymethyl)-60-methyl-13-oxa-37,38,43,44-tetrathia-27-azatridecacyclo[40.21.2.232,35.256,62.12,40.12,41.18,12.116,20.021,33.024,28.046,56.048,53.055,62]triheptaconta-3,8(73),9,11,16(72),17,19,24(28),25,32,34,48,50,52,64,66,70-heptadecaen-30-yne-5,23-dione
• 英文别名: 70-(diaminomethyl)-11,19,41,60-tetrahydroxy-47-(hydroxymethyl)-60-methyl-13-oxa-37,38,43,44-tetrathia-27-azatridecacyclo[40.21.2.232,35.256,62.12,40.12,41.18,12.116,20.021,33.024,28.046,56.048,53.055,62]triheptaconta-3,8(73),9,11,16(72),17,19,24(28),25,32,34,48,50,52,64,66,70-heptadecaen-30-yne-5,23-dione
• 化学式: C₇₀H₇₇N₃O₈S₄
• 分子量: 1216.6
• InChiKey: FECXJGQCMBJABG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.2
• 重原子数：
  85
• 可旋转键数：
  2
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.46
• 拓扑面积：
  314
• 氢给体数：
  8
• 氢受体数：
  14