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QUERCETIN-3-O-BETA-GLUCOPYRANOSIDE-URONIC_ACID-7-O-BETA-GLUCOPYRANOSIDE
SpectraBase Compound ID KMetiZwHlPG
InChI InChI=1S/C27H28O18/c28-6-13-15(32)17(34)20(37)26(43-13)41-8-4-11(31)14-12(5-8)42-22(7-1-2-9(29)10(30)3-7)23(16(14)33)44-27-21(38)18(35)19(36)24(45-27)25(39)40/h1-5,13,15,17-21,24,26-32,34-38H,6H2,(H,39,40)/t13-,15-,17+,18+,19+,20-,21-,24+,26-,27-/m1/s1
InChIKey FZJHCRDUXLHHKI-DGMRPHBWSA-N
Mol Weight 640.5 g/mol
Molecular Formula C27H28O18
Exact Mass 640.127564 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2tX20cLGDR6
Name QUERCETIN-3-O-BETA-GLUCOPYRANOSIDE-URONIC_ACID-7-O-BETA-GLUCOPYRANOSIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H28O18
InChI InChI=1S/C27H28O18/c28-6-13-15(32)17(34)20(37)26(43-13)41-8-4-11(31)14-12(5-8)42-22(7-1-2-9(29)10(30)3-7)23(16(14)33)44-27-21(38)18(35)19(36)24(45-27)25(39)40/h1-5,13,15,17-21,24,26-32,34-38H,6H2,(H,39,40)/t13-,15-,17+,18+,19+,20-,21-,24+,26-,27-/m1/s1
InChIKey FZJHCRDUXLHHKI-DGMRPHBWSA-N
Literature Reference Author C.FELSER,O.SCHIMMER
Literature Reference Citation PLANTA.MED.,65,668(1999)
Literature Reference DOI 10.1055/s-2006-960845
Molecular Weight 640.509 g/mol
Solvent DMSO-D6
Source File Reference UIAP1327