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
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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:
C44 H52 N2 O6
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
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