| SpectraBase Compound ID | IVw7spOV2TL |
|---|---|
| InChI | InChI=1S/C30H24O12/c31-13-7-19(36)24-23(8-13)41-30(12-2-4-16(33)18(35)6-12)29(39)26(24)25-20(37)10-22-14(28(25)42-30)9-21(38)27(40-22)11-1-3-15(32)17(34)5-11/h1-8,10,21,26-27,29,31-39H,9H2/t21-,26+,27-,29+,30-/m0/s1 |
| InChIKey | SHYPVJZSIOEHJY-VDUQXYFUSA-N |
| Mol Weight | 576.51 g/mol |
| Molecular Formula | C30H24O12 |
| Exact Mass | 576.126776 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Awi4c5ort8 |
|---|---|
| Name | EPICATECHIN-(2-BETA->5,4-BETA->6)-EPICATECHIN |
| Compound Number | 14 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H24O12 |
| InChI | InChI=1S/C30H24O12/c31-13-7-19(36)24-23(8-13)41-30(12-2-4-16(33)18(35)6-12)29(39)26(24)25-20(37)10-22-14(28(25)42-30)9-21(38)27(40-22)11-1-3-15(32)17(34)5-11/h1-8,10,21,26-27,29,31-39H,9H2/t21-,26+,27-,29+,30-/m0/s1 |
| InChIKey | SHYPVJZSIOEHJY-VDUQXYFUSA-N |
| Literature Reference Author | L.J.PORTER,Z.MA,B.G.CHAN |
| Literature Reference Citation | PHYTOCHEM.,30,1657(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)84228-K |
| Molecular Weight | 576.513 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU27504 |