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(-)-EPICATECHIN-3,5-DIGALLATE

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(-)-EPICATECHIN-3,5-DIGALLATE
SpectraBase Compound ID Ak7GMWjGBJN
InChI InChI=1S/C29H22O14/c30-14-8-22-15(23(9-14)42-28(39)12-4-18(33)25(37)19(34)5-12)10-24(27(41-22)11-1-2-16(31)17(32)3-11)43-29(40)13-6-20(35)26(38)21(36)7-13/h1-9,24,27,30-38H,10H2/t24-,27-/m1/s1
InChIKey RHDJFGKNTUPFEZ-SHQCIBLASA-N
Mol Weight 594.48 g/mol
Molecular Formula C29H22O14
Exact Mass 594.100955 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 32HzPQCSxgw
Name (-)-EPICATECHIN-3,5-DIGALLATE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H22O14
InChI InChI=1S/C29H22O14/c30-14-8-22-15(23(9-14)42-28(39)12-4-18(33)25(37)19(34)5-12)10-24(27(41-22)11-1-2-16(31)17(32)3-11)43-29(40)13-6-20(35)26(38)21(36)7-13/h1-9,24,27,30-38H,10H2/t24-,27-/m1/s1
InChIKey RHDJFGKNTUPFEZ-SHQCIBLASA-N
Literature Reference Author H.J.KIM,J.Y.LEE,S.M.KIM,D.A.PARK,C.JIN.S.P.HONG,Y.S.LEE
Literature Reference Citation FITOTERAPIA,80,73(2009)
Literature Reference DOI 10.1016/j.fitote.2008.10.003
Molecular Weight 594.485 g/mol
Solvent CD3OD
Source File Reference UWMB1010