![2-Amino-4-[1-(carboxymethyl-carbamoyl)-2-(2-oxo-2H-chromen-4-ylsulfanyl)-ethylcarbamoyl]-butyric acid](/api/spectrum/KJQDFZvWOhn/structure.png?h=300&w=458 "2-Amino-4-[1-(carboxymethyl-carbamoyl)-2-(2-oxo-2H-chromen-4-ylsulfanyl)-ethylcarbamoyl]-butyric acid")
| SpectraBase Compound ID | FE8o5z8wSv1 |
|---|---|
| InChI | InChI=1S/C19H21N3O8S/c20-11(19(28)29)5-6-15(23)22-12(18(27)21-8-16(24)25)9-31-14-7-17(26)30-13-4-2-1-3-10(13)14/h1-4,7,11-12H,5-6,8-9,20H2,(H,21,27)(H,22,23)(H,24,25)(H,28,29) |
| InChIKey | LKJYPPJXAQKJHK-UHFFFAOYSA-N |
| Mol Weight | 451.45 g/mol |
| Molecular Formula | C19H21N3O8S |
| Exact Mass | 451.104936 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | KJQDFZvWOhn |
|---|---|
| Name | 2-Amino-4-[1-(carboxymethyl-carbamoyl)-2-(2-oxo-2H-chromen-4-ylsulfanyl)-ethylcarbamoyl]-butyric acid |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C19H21N3O8S |
| InChI | InChI=1S/C19H21N3O8S/c20-11(19(28)29)5-6-15(23)22-12(18(27)21-8-16(24)25)9-31-14-7-17(26)30-13-4-2-1-3-10(13)14/h1-4,7,11-12H,5-6,8-9,20H2,(H,21,27)(H,22,23)(H,24,25)(H,28,29) |
| InChIKey | LKJYPPJXAQKJHK-UHFFFAOYSA-N |
| Instrument Name | Bruker AM-500 |
| NMR Standard | DMSO-D6 |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | DMSO-D6 |