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3,5,7,8,3',4'-HEXAHYDROXYFLAVONE-3-O-(6-PARA-COUMAROYL)-BETA-GLUCOPYRANOSIDE-7-METHYLETHER

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3,5,7,8,3',4'-HEXAHYDROXYFLAVONE-3-O-(6-PARA-COUMAROYL)-BETA-GLUCOPYRANOSIDE-7-METHYLETHER
SpectraBase Compound ID 22gkNYfTIFi
InChI InChI=1S/C31H28O15/c1-42-19-11-18(35)22-25(39)30(28(45-29(22)24(19)38)14-5-8-16(33)17(34)10-14)46-31-27(41)26(40)23(37)20(44-31)12-43-21(36)9-4-13-2-6-15(32)7-3-13/h2-11,20,23,26-27,31-35,37-38,40-41H,12H2,1H3/b9-4+/t20-,23-,26+,27-,31+/m1/s1
InChIKey SMQJRRCPGGOYKT-JYTUTVMXSA-N
Mol Weight 640.55 g/mol
Molecular Formula C31H28O15
Exact Mass 640.14282 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DafVjNrqG1T
Name 3,5,7,8,3',4'-HEXAHYDROXYFLAVONE-3-O-(6-PARA-COUMAROYL)-BETA-GLUCOPYRANOSIDE-7-METHYLETHER
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H28O15
InChI InChI=1S/C31H28O15/c1-42-19-11-18(35)22-25(39)30(28(45-29(22)24(19)38)14-5-8-16(33)17(34)10-14)46-31-27(41)26(40)23(37)20(44-31)12-43-21(36)9-4-13-2-6-15(32)7-3-13/h2-11,20,23,26-27,31-35,37-38,40-41H,12H2,1H3/b9-4+/t20-,23-,26+,27-,31+/m1/s1
InChIKey SMQJRRCPGGOYKT-JYTUTVMXSA-N
Literature Reference Author N.SULTANA,J.A.ARMSTRONG,P.G.WATERMAN
Literature Reference Citation PHYTOCHEM.,52,895(1999)
Literature Reference DOI 10.1016/S0031-9422(99)00338-6
Molecular Weight 640.554 g/mol
Solvent DMSO-D6
Source File Reference UWVN512