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EPICATECHIN-(4-BETA,8)-EPIGALLOCATECHIN

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EPICATECHIN-(4-BETA,8)-EPIGALLOCATECHIN
SpectraBase Compound ID B0QuUMOcvYx
InChI InChI=1S/C30H26O13/c31-12-6-17(35)23-22(7-12)42-29(10-1-2-14(32)16(34)3-10)27(41)25(23)24-18(36)9-15(33)13-8-21(39)28(43-30(13)24)11-4-19(37)26(40)20(38)5-11/h1-7,9,21,25,27-29,31-41H,8H2/t21-,25-,27-,28-,29-/m0/s1
InChIKey YJMNEZANCYQLJR-VGUKBLNFSA-N
Mol Weight 594.53 g/mol
Molecular Formula C30H26O13
Exact Mass 594.137341 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BR5iQp7gSic
Name EPICATECHIN-(4-BETA->8)-EPIGALLOCATECHIN
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H26O13
InChI InChI=1S/C30H26O13/c31-12-6-17(35)23-22(7-12)42-29(10-1-2-14(32)16(34)3-10)27(41)25(23)24-18(36)9-15(33)13-8-21(39)28(43-30(13)24)11-4-19(37)26(40)20(38)5-11/h1-7,9,21,25,27-29,31-41H,8H2/t21-,25-,27-,28-,29-/m0/s1
InChIKey YJMNEZANCYQLJR-VGUKBLNFSA-N
Literature Reference Author G.HUSSEIN,N.NAKAMURA,M.R.MESELHY,M.HATTORI
Literature Reference Citation PHYTOCHEM.,50,689(1999)
Literature Reference DOI 10.1016/S0031-9422(98)00571-8
Molecular Weight 594.529 g/mol
Solvent CD3OD
Source File Reference UWVN1415