| SpectraBase Spectrum ID |
LlK7C6wNG36 |
| Name |
Pyruvic acid |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
127-17-3
1892-67-7 |
| ChEBI ID |
32816 |
| Comments |
100 mM sodium pyruvate - vendor: Sigma p8574; Solvent: D2O; Buffers, etc: 50 mM Sodium Phosphate, 500 uM NaAzide; Temperature=298 K, pH=7.4; NMR Reference: 500 uM DSS; Bruker DMX 400MHz
(Data collected by Madison Metabolomics Consortium) |
| Copyright |
Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Data Source |
Madison Metabolomics Consortium |
| Formula |
C3H4O3 |
| IUPAC Name |
2-oxopropanoic acid; pyruvic acid |
| InChI |
InChI=1S/C3H4O3/c1-2(4)3(5)6/h1H3,(H,5,6) |
| InChIKey |
LCTONWCANYUPML-UHFFFAOYSA-N |
| KEGG Compound ID |
C00022 |
| KEGG Pathways |
PATH: map00750 Vitamin B6 metabolism |
| PubChem Compound ID |
107735 |
| SMILES |
CC(=O)C(=O)O |
| Source File Reference |
bmse000288 |
