Chem
J-GLOBAL ID：200907000116729784   Nikkaji number：J1.806.941E

5,17-[Ethylenebisoxybisethylenebis(nitrilomethylidyne)]-11,23-bis(tert-butyl)pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-25,26,27,28-tetraol

5,17-[エチレンビスオキシビスエチレンビス(ニトリロメチリジン)]-11,23-ビス(tert-ブチル)ペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-25,26,27,28-テトラオール
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C44H52N2O6
Molecular formula furigana： C44-H52-N2-O6
Molecular weight： 704.908
InChI： InChI=1S/C44H52N2O6/c1-43(2,3)37-21-33-17-29-13-27-15-31(39(29)47)19-35-23-38(44(4,5)6)24-36(42(35)50)20-32-16-28(14-30(40(32)48)18-34(22-37)41(33)49)26-46-8-10-52-12-11-51-9-7-45-25-27/h13-16,21-26,47-50H,7-12,17-20H2,1-6H3
InChI key： ULHHIYVRHBONDG-UHFFFAOYSA-N
SMILES： CC(C)(C)c1cc2Cc3cc4cc(Cc5cc(cc(Cc6cc(cc(Cc(c1)c2O)c6O)C=NCCOCCOCCN=C4)c5O)C(C)(C)C)c3O
Systematic name  (3)：
  • 5,17-[エチレンビスオキシビスエチレンビス(ニトリロメチリジン)]-11,23-ビス(tert-ブチル)ペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-25,26,27,28-テトラオール
  • 24,33-ジ-tert-ブチル-8,11-ジオキサ-5,14-ジアザヘキサシクロ[16.11.7.13,28.116,20.122,26.131,35]テトラコンタ-1,3(38),4,14,16,18,20(40),22(39),23,25,28,31(37),32,34-テトラデカエン-19,29,37,39-テトラオール
  • 24,33-di-tert-butyl-8,11-dioxa-5,14-diazahexacyclo[16.11.7.13,28.116,20.122,26.131,35]tetraconta-1,3(38),4,14,16,18,20(40),22(39),23,25,28,31(37),32,34-tetradecaene-19,29,37,39-tetrol
Other name (1)：
  • 5,17-[Ethylenebisoxybisethylenebis(nitrilomethylidyne)]-11,23-bis(tert-butyl)pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-25,26,27,28-tetraol
Thsaurus map：
Thesaurus Map

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