20,20-Dioxo-37-oxa-20lambda6-thia-8,15,25-triaza-32-azoniatridecacyclo[21.18.1.16,39.02,21.03,19.04,40.05,17.08,16.09,14.024,32.026,31.034,42.036,41]tritetraconta-1(42),2(21),3(19),4(40),5,9,11,13,15,17,22,24(32),26,28,30,34,36(41),39(43)-octadecaene-7,33-dione;ethane

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 萘并吡喃类
• 英文名称: 20,20-Dioxo-37-oxa-20lambda6-thia-8,15,25-triaza-32-azoniatridecacyclo[21.18.1.16,39.02,21.03,19.04,40.05,17.08,16.09,14.024,32.026,31.034,42.036,41]tritetraconta-1(42),2(21),3(19),4(40),5,9,11,13,15,17,22,24(32),26,28,30,34,36(41),39(43)-octadecaene-7,33-dione;ethane
• 英文别名: 20,20-dioxo-37-oxa-20λ6-thia-8,15,25-triaza-32-azoniatridecacyclo[21.18.1.16,39.02,21.03,19.04,40.05,17.08,16.09,14.024,32.026,31.034,42.036,41]tritetraconta-1(42),2(21),3(19),4(40),5,9,11,13,15,17,22,24(32),26,28,30,34,36(41),39(43)-octadecaene-7,33-dione;ethane
• 化学式: C43H33N4O5S+
• 分子量: 717.8
• InChiKey: QDFJRXVOJBXZCE-UHFFFAOYSA-O

计算性质

• 辛醇/水分配系数(LogP)：
  9.04
• 重原子数：
  53
• 可旋转键数：
  0
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.16
• 拓扑面积：
  123
• 氢给体数：
  1
• 氢受体数：
  6