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5,4'-DIHYDROXY-7-METHOXY-FLAVONE-6-C-(6'''-O-(E)-PARA-COUMAROYL)-BETA-D-GLUCOPYRANOSYL-(1'''->2'')-BETA-D-GLUCOPYRANOSIDE;ROTAMER-A

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5,4'-DIHYDROXY-7-METHOXY-FLAVONE-6-C-(6'''-O-(E)-PARA-COUMAROYL)-BETA-D-GLUCOPYRANOSYL-(1'''->2'')-BETA-D-GLUCOPYRANOSIDE;ROTAMER-A
SpectraBase Compound ID DvfCTAyHf9L
InChI InChI=1S/C37H38O17/c1-49-22-13-23-27(20(41)12-21(51-23)17-5-9-19(40)10-6-17)31(45)28(22)35-36(33(47)29(43)24(14-38)52-35)54-37-34(48)32(46)30(44)25(53-37)15-50-26(42)11-4-16-2-7-18(39)8-3-16/h2-13,24-25,29-30,32-40,43-48H,14-15H2,1H3/b11-4+/t24-,25-,29-,30-,32+,33+,34-,35+,36-,37+/m0/s1
InChIKey GIFDFLYIKYFTAD-YSDUTPQFSA-N
Mol Weight 754.7 g/mol
Molecular Formula C37H38O17
Exact Mass 754.2109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8iW9NiqqSfM
Name 5,4'-DIHYDROXY-7-METHOXY-FLAVONE-6-C-(6'''-O-(E)-PARA-COUMAROYL)-BETA-D-GLUCOPYRANOSYL-(1'''->2'')-BETA-D-GLUCOPYRANOSIDE;ROTAMER-B
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H38O17
InChI InChI=1S/C37H38O17/c1-49-22-13-23-27(20(41)12-21(51-23)17-5-9-19(40)10-6-17)31(45)28(22)35-36(33(47)29(43)24(14-38)52-35)54-37-34(48)32(46)30(44)25(53-37)15-50-26(42)11-4-16-2-7-18(39)8-3-16/h2-13,24-25,29-30,32-40,43-48H,14-15H2,1H3/b11-4+/t24-,25-,29-,30-,32+,33+,34-,35+,36-,37+/m0/s1
InChIKey GIFDFLYIKYFTAD-YSDUTPQFSA-N
Literature Reference Author R.FANG,N.C.VEITCH,G.C.KITE,M.J.R.HOWES,E.A.PORTER,M.S.J.SIMM ONDS
Literature Reference Citation CHEM.PHARM.BULL.,59,124(2011)
Literature Reference DOI 10.1248/cpb.59.124
Molecular Weight 754.699 g/mol
Sample ID 2660
Solvent CD3OD