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TRICETIFLAVAN-7-O-GALLATE;7-O-GALLOYLTRICETIFLAVAN
SpectraBase Compound ID HInLmKa2P7m
InChI InChI=1S/C22H18O10/c23-13-7-11(31-22(30)10-5-16(26)21(29)17(27)6-10)8-19-12(13)1-2-18(32-19)9-3-14(24)20(28)15(25)4-9/h3-8,18,23-29H,1-2H2
InChIKey XQLJWQWRTLHKGO-UHFFFAOYSA-N
Mol Weight 442.38 g/mol
Molecular Formula C22H18O10
Exact Mass 442.089997 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FNqsqalePi
Name TRICETIFLAVAN-7-O-GALLATE;7-O-GALLOYLTRICETIFLAVAN
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H18O10
InChI InChI=1S/C22H18O10/c23-13-7-11(31-22(30)10-5-16(26)21(29)17(27)6-10)8-19-12(13)1-2-18(32-19)9-3-14(24)20(28)15(25)4-9/h3-8,18,23-29H,1-2H2
InChIKey XQLJWQWRTLHKGO-UHFFFAOYSA-N
Literature Reference Author Y.LI,K.T.LEUNG,F.YAO,L.S.M.OOI,V.E.C.OOI
Literature Reference Citation J.NAT.PROD.,69,833(2006)
Literature Reference DOI 10.1021/np050498o
Molecular Weight 442.379 g/mol
Solvent CD3OD
Source File Reference UWMZ18439