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QUERCETIN-7-O-BETA-(6''-GALLOYLGLUCOPYRANOSIDE)

View entire compound with spectra: 1 NMR

QUERCETIN-7-O-BETA-(6''-GALLOYLGLUCOPYRANOSIDE)
SpectraBase Compound ID 1CCTkBNnKIb
InChI InChI=1S/C28H24O16/c29-12-2-1-9(3-13(12)30)26-24(38)22(36)19-14(31)6-11(7-17(19)43-26)42-28-25(39)23(37)21(35)18(44-28)8-41-27(40)10-4-15(32)20(34)16(33)5-10/h1-7,18,21,23,25,28-35,37-39H,8H2/t18-,21-,23+,25-,28-/m1/s1
InChIKey USBMLXYFQKQZDJ-JXOXKRRHSA-N
Mol Weight 616.48 g/mol
Molecular Formula C28H24O16
Exact Mass 616.106435 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6xOhvmIXGMI
Name QUERCETIN-7-O-BETA-(6''-GALLOYLGLUCOPYRANOSIDE)
Compound Number 4
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H24O16
InChI InChI=1S/C28H24O16/c29-12-2-1-9(3-13(12)30)26-24(38)22(36)19-14(31)6-11(7-17(19)43-26)42-28-25(39)23(37)21(35)18(44-28)8-41-27(40)10-4-15(32)20(34)16(33)5-10/h1-7,18,21,23,25,28-35,37-39H,8H2/t18-,21-,23+,25-,28-/m1/s1
InChIKey USBMLXYFQKQZDJ-JXOXKRRHSA-N
Literature Reference Author H.H.BARAKAT,A.M.SOULEMAN,S.A.M.HUSSEIN,O.A.IBRAHIEM,M.A.M.NA WWAR
Literature Reference Citation PHYTOCHEM.,51,139(1999)
Literature Reference DOI 10.1016/S0031-9422(97)00010-1
Molecular Weight 616.489 g/mol
Solvent DMSO-D6
Source File Reference UWLU1567