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#5H;2-[2-OXO-7-[[4-OXO-2-(3-PHENOXYPHENYL)-THIAZOLIDIN-3-YLCARBAMOYL]-METHOXY]-2H-CHROMEN-4-YL]-N-[4-OXO-2-(3-PHENOXYPHENYL)-THIAZOLIDIN-3-YL]-ACETAMIDE
SpectraBase Compound ID 5DOqHMhrmjl
InChI InChI=1S/C43H34N4O9S2/c48-37(44-46-39(50)25-57-42(46)27-9-7-15-33(19-27)54-30-11-3-1-4-12-30)21-29-22-41(52)56-36-23-32(17-18-35(29)36)53-24-38(49)45-47-40(51)26-58-43(47)28-10-8-16-34(20-28)55-31-13-5-2-6-14-31/h1-20,22-23,42-43H,21,24-26H2,(H,44,48)(H,45,49)
InChIKey NKAOBXFTAIULEQ-UHFFFAOYSA-N
Mol Weight 814.9 g/mol
Molecular Formula C43H34N4O9S2
Exact Mass 814.176721 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D46c5A6oiAi
Name #5H;2-[2-OXO-7-[[4-OXO-2-(3-PHENOXYPHENYL)-THIAZOLIDIN-3-YLCARBAMOYL]-METHOXY]-2H-CHROMEN-4-YL]-N-[4-OXO-2-(3-PHENOXYPHENYL)-THIAZOLIDIN-3-YL]-ACETAMIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C43H34N4O9S2
InChI InChI=1S/C43H34N4O9S2/c48-37(44-46-39(50)25-57-42(46)27-9-7-15-33(19-27)54-30-11-3-1-4-12-30)21-29-22-41(52)56-36-23-32(17-18-35(29)36)53-24-38(49)45-47-40(51)26-58-43(47)28-10-8-16-34(20-28)55-31-13-5-2-6-14-31/h1-20,22-23,42-43H,21,24-26H2,(H,44,48)(H,45,49)
InChIKey NKAOBXFTAIULEQ-UHFFFAOYSA-N
Literature Reference Author M.CACIC,M.MOLNAR,T.BALIC,N.DRACA,V.RAJKOVIC
Literature Reference Citation MOLECULES,14,2501(2009)
Literature Reference DOI 10.3390/molecules14072501
Molecular Weight 814.884 g/mol
Sample ID 69599
Solvent DMSO-D6