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EPICATECHIN-(2-BETA->O->7,4-BETA->6)-CATECHIN-HEXAMETHYLETHER

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EPICATECHIN-(2-BETA->O->7,4-BETA->6)-CATECHIN-HEXAMETHYLETHER
SpectraBase Compound ID IL2Z6Bu923I
InChI InChI=1S/C36H36O12/c1-40-19-13-27(45-6)30-28(14-19)47-36(18-8-10-23(42-3)26(12-18)44-5)35(39)32(30)31-29(48-36)16-24-20(33(31)38)15-21(37)34(46-24)17-7-9-22(41-2)25(11-17)43-4/h7-14,16,21,32,34-35,37-39H,15H2,1-6H3/t21?,32-,34-,35-,36+/m0/s1
InChIKey DOZMOLNHAVKBRT-CHALOXRZSA-N
Mol Weight 660.7 g/mol
Molecular Formula C36H36O12
Exact Mass 660.220677 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2IvRG7UIfg9
Name EPICATECHIN-(2-BETA->O->7,4-BETA->6)-CATECHIN-HEXAMETHYLETHER
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H36O12
InChI InChI=1S/C36H36O12/c1-40-19-13-27(45-6)30-28(14-19)47-36(18-8-10-23(42-3)26(12-18)44-5)35(39)32(30)31-29(48-36)16-24-20(33(31)38)15-21(37)34(46-24)17-7-9-22(41-2)25(11-17)43-4/h7-14,16,21,32,34-35,37-39H,15H2,1-6H3/t21?,32-,34-,35-,36+/m0/s1
InChIKey DOZMOLNHAVKBRT-CHALOXRZSA-N
Literature Reference Author H.LOU,Y.YAMAZAKI,T.SASAKI,M.UCHIDA,H.TANAKA,S.OKA
Literature Reference Citation PHYTOCHEM.,51,297(1999)
Literature Reference DOI 10.1016/S0031-9422(98)00736-5
Molecular Weight 660.675 g/mol
Solvent CDCl3
Source File Reference UWUC274