Dimethyl 6-carbamoyl-3,9,17,42-tetraoxo-19,40-dioxa-2,10,16,43,48,49-hexazaoctacyclo[42.3.1.14,8.111,15.020,29.023,28.030,39.031,36]pentaconta-1(47),4(50),5,7,11,13,15(49),20(29),21,23,25,27,30(39),31,33,35,37,44(48),45-nonadecaene-21,38-dicarboxylate

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: Dimethyl 6-carbamoyl-3,9,17,42-tetraoxo-19,40-dioxa-2,10,16,43,48,49-hexazaoctacyclo[42.3.1.14,8.111,15.020,29.023,28.030,39.031,36]pentaconta-1(47),4(50),5,7,11,13,15(49),20(29),21,23,25,27,30(39),31,33,35,37,44(48),45-nonadecaene-21,38-dicarboxylate
• 英文别名: dimethyl 6-carbamoyl-3,9,17,42-tetraoxo-19,40-dioxa-2,10,16,43,48,49-hexazaoctacyclo[42.3.1.14,8.111,15.020,29.023,28.030,39.031,36]pentaconta-1(47),4(50),5,7,11,13,15(49),20(29),21,23,25,27,30(39),31,33,35,37,44(48),45-nonadecaene-21,38-dicarboxylate
• 化学式: C₄₇H₃₅N₇O₁₁
• 分子量: 873.8
• InChiKey: MNOOEFPULLSYIQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.3
• 重原子数：
  65
• 可旋转键数：
  5
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.09
• 拓扑面积：
  256
• 氢给体数：
  5
• 氢受体数：
  13

文献信息

• OPTICAL-ISOMER SEPARATING AGENT FOR CHROMATOGRAPHY AND PROCESS FOR PRODUCING THE SAME
  申请人：National University Corporation Okayama University

  公开号：EP2239565B1

  公开（公告）日：2014-08-27