| SpectraBase Compound ID | 6RYygKcB4vR |
|---|---|
| InChI | InChI=1S/C18H23N3O8S/c19-11(17(27)28)6-7-13(22)21-12(16(26)20-8-14(23)24)9-30-18(29)15(25)10-4-2-1-3-5-10/h1-5,11-12,15,25H,6-9,19H2,(H,20,26)(H,21,22)(H,23,24)(H,27,28) |
| InChIKey | YUKXYNWSJMQEBV-UHFFFAOYSA-N |
| Mol Weight | 441.46 g/mol |
| Molecular Formula | C18H23N3O8S |
| Exact Mass | 441.120586 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A4pzA0yjjtS |
|---|---|
| Name | S-Mandelyl-glutathione |
| Comments | SODIUM PHOSPHATE BUFFER, PH=6.6 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C18H23N3O8S |
| InChI | InChI=1S/C18H23N3O8S/c19-11(17(27)28)6-7-13(22)21-12(16(26)20-8-14(23)24)9-30-18(29)15(25)10-4-2-1-3-5-10/h1-5,11-12,15,25H,6-9,19H2,(H,20,26)(H,21,22)(H,23,24)(H,27,28) |
| InChIKey | YUKXYNWSJMQEBV-UHFFFAOYSA-N |
| Literature Reference | J.D. Clelland, P.J. Thornalley, J. Chem. Soc. Perkin I 3009 (1991). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |