John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=1wFTq4V2A4W SpectraBase Spectrum ID=11SbgnWoi4p

(accessed ).
EPICATECHIN-4'-SULFATE_AMMONIUM_SALT
SpectraBase Compound ID 1wFTq4V2A4W
InChI InChI=1S/C15H14O9S.H3N/c16-8-4-10(17)9-6-12(19)15(23-14(9)5-8)7-1-2-13(11(18)3-7)24-25(20,21)22;/h1-5,12,15-19H,6H2,(H,20,21,22);1H3/t12-,15-;/m1./s1
InChIKey WTHJJRPAIYZFGJ-XRZFDKQNSA-N
Mol Weight 383.33 g/mol
Molecular Formula C15H13NO9S
Exact Mass 383.031103 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 11SbgnWoi4p
Name EPICATECHIN-4'-SULFATE_AMMONIUM_SALT
Compound Number 2S
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H13NO9S
InChI InChI=1S/C15H14O9S.H3N/c16-8-4-10(17)9-6-12(19)15(23-14(9)5-8)7-1-2-13(11(18)3-7)24-25(20,21)22;/h1-5,12,15-19H,6H2,(H,20,21,22);1H3/t12-,15-;/m1./s1
InChIKey WTHJJRPAIYZFGJ-XRZFDKQNSA-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 383.330 g/mol
Sample ID 42045
Solvent DMSO-D6
SpectraBase Batch ID kKcx2VA4M6