| SpectraBase Spectrum ID |
EbSoPgFbCNB |
| Name |
Barbituric acid |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
16564-27-5; 32267-40-6; 160336-60-7 |
| ChEBI ID |
16294 |
| Comments |
100 mM Barbituric acid - Sigma-Aldrich; Solvent D2O; Buffer sodium phosphate; Cytocide sodium azide; Reference DSS; pH 7.4, temperature 298 K |
| Copyright |
Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Data Source |
Madison Metabolomics Consortium |
| Formula |
C4 H4 N2 O3 |
| IUPAC Name |
1,3-diazinane-2,4,6-trione; barbituric acid; hexahydropyrimidine-2,4,6-trione |
| InChI |
InChI=1S/C4H4N2O3/c7-2-1-3(8)6-4(9)5-2/h1H2,(H2,5,6,7,8,9) |
| InChIKey |
HNYOPLTXPVRDBG-UHFFFAOYSA-N |
| KEGG Compound ID |
C00813 |
| KEGG Pathways |
PATH: ko00240 Pyrimidine metabolism |
| PubChem Compound ID |
6211 |
| SMILES |
C1C(=O)NC(=O)NC1=O |
| Source File Reference |
bmse000346 |
