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KAEMPFEROL-3-O-BETA-D-[2-(E)-5-HYDROXYFERULOYL-BETA-D-GLUCOPYRANOSYL-(1->2)-GLUCOPYRANOSIDE]-7-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 6DfWsjPsXDk
InChI InChI=1S/C43H48O25/c1-60-22-9-15(8-20(49)28(22)51)2-7-26(50)66-39-34(57)30(53)24(13-45)64-42(39)68-40-35(58)31(54)25(14-46)65-43(40)67-38-32(55)27-19(48)10-18(61-41-36(59)33(56)29(52)23(12-44)63-41)11-21(27)62-37(38)16-3-5-17(47)6-4-16/h2-11,23-25,29-31,33-36,39-49,51-54,56-59H,12-14H2,1H3/b7-2+/t23-,24+,25+,29-,30+,31+,33+,34-,35-,36-,39+,40+,41-,42-,43-/m0/s1
InChIKey YTDGQVHPSYULRP-NVZKOOOUSA-N
Mol Weight 964.8 g/mol
Molecular Formula C43H48O25
Exact Mass 964.248467 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KiNCxQWNyyD
Name KAEMPFEROL-3-O-BETA-D-[2-(E)-5-HYDROXYFERULOYL-BETA-D-GLUCOPYRANOSYL-(1->2)-GLUCOPYRANOSIDE]-7-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 19G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C43H48O25
InChI InChI=1S/C43H48O25/c1-60-22-9-15(8-20(49)28(22)51)2-7-26(50)66-39-34(57)30(53)24(13-45)64-42(39)68-40-35(58)31(54)25(14-46)65-43(40)67-38-32(55)27-19(48)10-18(61-41-36(59)33(56)29(52)23(12-44)63-41)11-21(27)62-37(38)16-3-5-17(47)6-4-16/h2-11,23-25,29-31,33-36,39-49,51-54,56-59H,12-14H2,1H3/b7-2+/t23-,24+,25+,29-,30+,31+,33+,34-,35-,36-,39+,40+,41-,42-,43-/m0/s1
InChIKey YTDGQVHPSYULRP-NVZKOOOUSA-N
Literature Reference Author M.S.C.PEDRAS,Q.A.ZHENG,R.S.GADAGI,S.R.RIMMER
Literature Reference Citation PHYTOCHEM.,69,894(2008)
Literature Reference DOI 10.1016/j.phytochem.2007.10.019
Molecular Weight 964.839 g/mol
Sample ID 43223
Solvent D2O