PROCYANIDIN-B2;EPICATECHIN-4-BETA-8-EPICATECHIN;EXTENDED
Compound with spectra: 6 NMR
| 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 |
This compound is available in the following databases:
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.