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GALLOCATECHIN-3'-OR-4'-O-GALLATE

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GALLOCATECHIN-3'-OR-4'-O-GALLATE
SpectraBase Compound ID CJPNh85oPoy
InChI InChI=1S/2C22H18O11/c2*23-10-5-12(24)11-7-16(28)21(32-17(11)6-10)8-1-15(27)20(30)18(4-8)33-22(31)9-2-13(25)19(29)14(26)3-9/h2*1-6,16,21,23-30H,7H2/t2*16-,21+/m00/s1
InChIKey BVPPHBRAKNQSPH-UZWCWUOUSA-N
Mol Weight 916.75 g/mol
Molecular Formula C44H36O22
Exact Mass 916.169823 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BaO8oVX5dV
Name GALLOCATECHIN-3'-OR-4'-O-GALLATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H36O22
InChI InChI=1S/2C22H18O11/c2*23-10-5-12(24)11-7-16(28)21(32-17(11)6-10)8-1-15(27)20(30)18(4-8)33-22(31)9-2-13(25)19(29)14(26)3-9/h2*1-6,16,21,23-30H,7H2/t2*16-,21+/m00/s1
InChIKey BVPPHBRAKNQSPH-UZWCWUOUSA-N
Literature Reference Author M.W.LEE,S.MORIMOTO,G.I.NONAKA,I.NISHIOKA
Literature Reference Citation PHYTOCHEM.,31,2117(1992)
Literature Reference DOI 10.1016/0031-9422(92)80375-O
Molecular Weight 916.757 g/mol
Solvent ACETONE-D6:D2O
Source File Reference UWVN22149