| SpectraBase Compound ID | 3KOzoUSlsCV |
|---|---|
| InChI | InChI=1S/C17H18O8S/c18-1-2-26-17-13-9(20)5-8(19)6-12(13)25-16(15(17)24)7-3-10(21)14(23)11(22)4-7/h3-6,15-24H,1-2H2/t15-,16+,17-/m0/s1 |
| InChIKey | OXGDROUGXCPVBP-BBWFWOEESA-N |
| Mol Weight | 382.38 g/mol |
| Molecular Formula | C17H18O8S |
| Exact Mass | 382.072239 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HuRuEPErDeS |
|---|---|
| Name | 4-beta-(2-HYDROXY-ETHYL-SULFONYL)-EPIGALLOCATECHIN |
| Compound Number | 3 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C17H18O8S/c18-1-2-26-17-13-9(20)5-8(19)6-12(13)25-16(15(17)24)7-3-10(21)14(23)11(22)4-7/h3-6,15-24H,1-2H2/t15-,16+,17-/m0/s1 |
| InChIKey | OXGDROUGXCPVBP-BBWFWOEESA-N |
| Literature Reference | T.TANAKA,R.TAKAHASHI,I.KOUNO,G.NONAKA J.CHEM.SOC.PERKIN-1,3013(1994) |
| Solvent | Acetone-d6:Deuterium oxide |