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(2S,3R)-3,3',5'-TRIHYDROXY-FLAVANE-4',5-DI-O-GALLATE
SpectraBase Compound ID LybjMTUlD1Z
InChI InChI=1S/C29H22O15/c30-13-7-22-14(23(8-13)43-28(40)11-3-15(31)24(38)16(32)4-11)9-21(37)26(42-22)10-1-19(35)27(20(36)2-10)44-29(41)12-5-17(33)25(39)18(34)6-12/h1-8,21,26,30-39H,9H2/t21-,26+/m1/s1
InChIKey OWCQBVVYYPZOSW-RLWLMLJZSA-N
Mol Weight 610.48 g/mol
Molecular Formula C29H22O15
Exact Mass 610.09587 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1EJrAF24aGY
Name (2S,3R)-3,3',5'-TRIHYDROXY-FLAVANE-4',5-DI-O-GALLATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H22O15
InChI InChI=1S/C29H22O15/c30-13-7-22-14(23(8-13)43-28(40)11-3-15(31)24(38)16(32)4-11)9-21(37)26(42-22)10-1-19(35)27(20(36)2-10)44-29(41)12-5-17(33)25(39)18(34)6-12/h1-8,21,26,30-39H,9H2/t21-,26+/m1/s1
InChIKey OWCQBVVYYPZOSW-RLWLMLJZSA-N
Literature Reference Author A.M.AL-TAWEEL,S.PERVEEN,G.A.FAWZY,S.I.ALQASOUMI,K.E.H.E.ELTA HIR
Literature Reference Citation FITOTERAPIA,83,1610(2012)
Literature Reference DOI 10.1016/j.fitote.2012.09.010
Molecular Weight 610.485 g/mol
Sample ID 72116
Solvent CD3OD