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Methyl 3,4,5-tris(3',4'-dimethoxy-cinnamoyl)-quinate

View entire compound with spectra: 1 NMR

Methyl 3,4,5-tris(3',4'-dimethoxy-cinnamoyl)-quinate
SpectraBase Compound ID 4le8tUwg4Qs
InChI InChI=1S/C41H44O15/c1-47-28-14-8-25(20-31(28)50-4)11-17-36(42)54-34-23-41(46,40(45)53-7)24-35(55-37(43)18-12-26-9-15-29(48-2)32(21-26)51-5)39(34)56-38(44)19-13-27-10-16-30(49-3)33(22-27)52-6/h8-22,34-35,39,46H,23-24H2,1-7H3/b17-11+,18-12+,19-13-
InChIKey GAYFTYYLLJNSQA-IBEMCFTBSA-N
Mol Weight 776.8 g/mol
Molecular Formula C41H44O15
Exact Mass 776.268021 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A0rQumh6hXZ
Name Methyl 3,4,5-tris(3',4'-dimethoxy-cinnamoyl)-quinate
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C41H44O15
InChI InChI=1S/C41H44O15/c1-47-28-14-8-25(20-31(28)50-4)11-17-36(42)54-34-23-41(46,40(45)53-7)24-35(55-37(43)18-12-26-9-15-29(48-2)32(21-26)51-5)39(34)56-38(44)19-13-27-10-16-30(49-3)33(22-27)52-6/h8-22,34-35,39,46H,23-24H2,1-7H3/b17-11+,18-12+,19-13-
InChIKey GAYFTYYLLJNSQA-IBEMCFTBSA-N
Literature Reference B. Timmermann, J.J. Hoffmann, J. Nat. Prod. (lloydia) 46, 365 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3