| SpectraBase Compound ID | 5bgN6Fn1OA6 |
|---|---|
| InChI | InChI=1S/C16H22N6O3S/c17-14(26)12-2-1-5-22(12)16(25)11(6-9-7-18-8-19-9)21-15(24)10-3-4-13(23)20-10/h7-8,10-12H,1-6H2,(H2,17,26)(H,18,19)(H,20,23)(H,21,24)/t10-,11-,12-/m1/s1 |
| InChIKey | XDMCHYGXDNNEPU-IJLUTSLNSA-N |
| Mol Weight | 378.45 g/mol |
| Molecular Formula | C16H22N6O3S |
| Exact Mass | 378.14741 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FkzRZWS4C3n |
|---|---|
| Name | L-PYROGLUTAMYL-L-HISTIDYL-L-PROLINE THIOAMIDE |
| Comments | 12 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C16H22N6O3S |
| InChI | InChI=1S/C16H22N6O3S/c17-14(26)12-2-1-5-22(12)16(25)11(6-9-7-18-8-19-9)21-15(24)10-3-4-13(23)20-10/h7-8,10-12H,1-6H2,(H2,17,26)(H,18,19)(H,20,23)(H,21,24)/t10-,11-,12-/m1/s1 |
| InChIKey | XDMCHYGXDNNEPU-IJLUTSLNSA-N |
| Instrument Name | Jeol FX-60 |
| Literature Reference | M.KRUSZYNSKI (1986) Polish Journal of Chemistry: v.60, 96-105. |
| NMR Standard | C2D6OS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | DMSO-D6 |