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PROCYANIDIN-B2;EPICATECHIN-4-BETA-8-EPICATECHIN;EXTENDED
SpectraBase Compound ID 4VsLhCbSYqC
InChI InChI=1S/C30H26O12/c31-13-7-20(37)24-23(8-13)41-29(12-2-4-16(33)19(36)6-12)27(40)26(24)25-21(38)10-17(34)14-9-22(39)28(42-30(14)25)11-1-3-15(32)18(35)5-11/h1-8,10,22,26-29,31-40H,9H2/t22-,26-,27-,28-,29-/m1/s1
InChIKey XFZJEEAOWLFHDH-NFJBMHMQSA-N
Mol Weight 578.53 g/mol
Molecular Formula C30H26O12
Exact Mass 578.142426 g/mol
Enantiomer InChIKey XFZJEEAOWLFHDH-WQJHFXEDSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent ACETONE-D6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3OD
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent H2O:D2O=9:1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent H2O:D2O=9:1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • EPICATECHIN-4-BETA,8-EPICATECHIN;MAJOR-ISOMER
  • EPICATECHIN-4-BETA,8-EPICATECHIN;MINOR-ISOMER
  • PROCYANIDIN-B2;EPICATECHIN-4-BETA-8-EPICATECHIN;COMPACT
  • EPICATECHIN-(4-BETA->8)-EPICATECHIN
  • PROCYANIDIN-B2
Title Journal or Book Year
A 3D structural and conformational study of procyanidin dimers in water and hydro-alcoholic media as viewed by NMR and molecular modeling Magnetic Resonance in Chemistry 2006
Procyanidin Production byFagopyrum esculentumCallus Culture Planta Medica 1992
Cacao procyanidins: major flavanoids and identification of some minor metabolites Phytochemistry 1991

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