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(+)-CATECHIN-3-O-BETA-D-GLUCO-(6-CINNAMOYL)-PYRANOSIDE
SpectraBase Compound ID J9iqqjgzDbb
InChI InChI=1S/C30H30O12/c31-14-24-26(37)27(38)29(42-25(36)9-6-15-4-2-1-3-5-15)30(41-24)40-23-13-18-20(34)11-17(32)12-22(18)39-28(23)16-7-8-19(33)21(35)10-16/h1-12,23-24,26-35,37-38H,13-14H2/b9-6+/t23-,24+,26+,27-,28+,29+,30+/m1/s1
InChIKey SKGHMIPXASYQPA-OFZPJRNZSA-N
Mol Weight 582.56 g/mol
Molecular Formula C30H30O12
Exact Mass 582.173726 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D27OzeKbp3w
Name (+)-CATECHIN-3-O-BETA-D-GLUCO-(6-CINNAMOYL)-PYRANOSIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H30O12
InChI InChI=1S/C30H30O12/c31-14-24-26(37)27(38)29(42-25(36)9-6-15-4-2-1-3-5-15)30(41-24)40-23-13-18-20(34)11-17(32)12-22(18)39-28(23)16-7-8-19(33)21(35)10-16/h1-12,23-24,26-35,37-38H,13-14H2/b9-6+/t23-,24+,26+,27-,28+,29+,30+/m1/s1
InChIKey SKGHMIPXASYQPA-OFZPJRNZSA-N
Literature Reference Author J.LOKVAM,P.D.COLEY,T.A.KURSAR
Literature Reference Citation PHYTOCHEM.,65,351(2004)
Literature Reference DOI 10.1016/j.phytochem.2003.11.012
Molecular Weight 582.561 g/mol
Solvent ACETONE-D6
Source File Reference UWVN31382