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EPICATECHIN-(2-BETA->O->7,4-BETA->8)-ENT-EPICATECHIN

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EPICATECHIN-(2-BETA->O->7,4-BETA->8)-ENT-EPICATECHIN
SpectraBase Compound ID ApZqd9t9fzX
InChI InChI=1S/C30H24O12/c31-13-7-20(37)24-22(8-13)41-30(12-2-4-16(33)19(36)6-12)29(39)26(24)25-23(42-30)10-17(34)14-9-21(38)27(40-28(14)25)11-1-3-15(32)18(35)5-11/h1-8,10,21,26-27,29,31-39H,9H2/t21-,26+,27-,29+,30-/m1/s1
InChIKey NSEWTSAADLNHNH-JXCVSLFXSA-N
Mol Weight 576.51 g/mol
Molecular Formula C30H24O12
Exact Mass 576.126776 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2rzWAaP8E2U
Name EPICATECHIN-(2-BETA->O->7,4-BETA->8)-ENT-EPICATECHIN
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H24O12
InChI InChI=1S/C30H24O12/c31-13-7-20(37)24-22(8-13)41-30(12-2-4-16(33)19(36)6-12)29(39)26(24)25-23(42-30)10-17(34)14-9-21(38)27(40-28(14)25)11-1-3-15(32)18(35)5-11/h1-8,10,21,26-27,29,31-39H,9H2/t21-,26+,27-,29+,30-/m1/s1
InChIKey NSEWTSAADLNHNH-JXCVSLFXSA-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 576.513 g/mol
Solvent CD3OD
Source File Reference UWUC266