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GALLOCATECHIN-7-O-GALLATE
SpectraBase Compound ID 5xWRjbIxKgK
InChI InChI=1S/C22H18O11/c23-12-5-10(32-22(31)9-3-15(26)20(30)16(27)4-9)6-18-11(12)7-17(28)21(33-18)8-1-13(24)19(29)14(25)2-8/h1-6,17,21,23-30H,7H2/t17-,21+/m0/s1
InChIKey YKMHMATZTMIDNU-LAUBAEHRSA-N
Mol Weight 458.38 g/mol
Molecular Formula C22H18O11
Exact Mass 458.084911 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4LGFp14aDBD
Name GALLOCATECHIN-7-O-GALLATE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H18O11
InChI InChI=1S/C22H18O11/c23-12-5-10(32-22(31)9-3-15(26)20(30)16(27)4-9)6-18-11(12)7-17(28)21(33-18)8-1-13(24)19(29)14(25)2-8/h1-6,17,21,23-30H,7H2/t17-,21+/m0/s1
InChIKey YKMHMATZTMIDNU-LAUBAEHRSA-N
Literature Reference Author M.MALDINI,P.MONTORO,A.I.HAMED,U.A.MAHALEI,W.OLESZEK,A.STOCHM AL,S.PIACENTE
Literature Reference Citation J.PHARM.BIOM.ANAL.,56,228(2011)
Literature Reference DOI 10.1016/j.jpba.2011.05.019
Molecular Weight 458.378 g/mol
Solvent CD3OD
Source File Reference UWMZ44131