| SpectraBase Spectrum ID |
5YiVSzaLagG |
| Name |
Uracil |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
144104-68-7
42910-77-0
4433-21-0
4433-24-3
66-22-8
766-19-8 |
| ChEBI ID |
17568 |
| Comments |
saturated N/A Uracil - vendor: MP Biomedicals 194761; 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 |
C4H4N2O2 |
| IUPAC Name |
1H-pyrimidine-2,4-quinone; 1H-pyrimidine-2,4-dione; pyrimidine-2,4-diol |
| InChI |
InChI=1S/C4H4N2O2/c7-3-1-2-5-4(8)6-3/h1-2H,(H2,5,6,7,8) |
| InChIKey |
ISAKRJDGNUQOIC-UHFFFAOYSA-N |
| KEGG Compound ID |
C00106 |
| KEGG Pathways |
PATH: map00240 Pyrimidine metabolism
PATH: map00410 beta-Alanine metabolism
PATH: map00770 Pantothenate and CoA biosynthesis |
| PubChem Compound ID |
1174 |
| SMILES |
C1=CNC(=O)NC1=O |
| Source File Reference |
bmse000187 |
