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EPICATECHIN-4'-O-BETA-D-GLUCURONIDE
SpectraBase Compound ID 2nH0rFtDaKj
InChI InChI=1S/C21H22O12/c22-8-4-10(23)9-6-12(25)18(31-14(9)5-8)7-1-2-13(11(24)3-7)32-21-17(28)15(26)16(27)19(33-21)20(29)30/h1-5,12,15-19,21-28H,6H2,(H,29,30)/t12-,15-,16-,17+,18-,19-,21+/m1/s1
InChIKey FXAMKGHSKXKNHR-ANWMZRCSSA-N
Mol Weight 466.4 g/mol
Molecular Formula C21H22O12
Exact Mass 466.111126 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K1KMGN73nhk
Name EPICATECHIN-4'-O-BETA-D-GLUCURONIDE
Compound Number 2G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22O12
InChI InChI=1S/C21H22O12/c22-8-4-10(23)9-6-12(25)18(31-14(9)5-8)7-1-2-13(11(24)3-7)32-21-17(28)15(26)16(27)19(33-21)20(29)30/h1-5,12,15-19,21-28H,6H2,(H,29,30)/t12-,15-,16-,17+,18-,19-,21+/m1/s1
InChIKey FXAMKGHSKXKNHR-ANWMZRCSSA-N
Literature Reference Author M.ZHANG,G.E.JAGDMANN,M.VANZANDT,R.SHEELER,P.BECKETT,H.SCHROE TER
Literature Reference Citation J.NAT.PROD.,76,157(2013)
Literature Reference DOI 10.1021/np300568m
Molecular Weight 466.398 g/mol
Sample ID 42034
Solvent ACETONE-D6