| SpectraBase Spectrum ID |
8JowHoMRUiS |
| Name |
Cytosine |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
118511-36-7
14987-28-1
26661-23-4
504-05-2
66322-75-6
71-30-7 |
| ChEBI ID |
16040 |
| Comments |
saturated N/A Cytosine - vendor: Acros 161760010; 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 |
C4H5N3O |
| IUPAC Name |
4-amino-3H-pyrimidin-2-one |
| InChI |
InChI=1S/C4H5N3O/c5-3-1-2-6-4(8)7-3/h1-2H,(H3,5,6,7,8) |
| InChIKey |
OPTASPLRGRRNAP-UHFFFAOYSA-N |
| KEGG Compound ID |
C00380 |
| KEGG Pathways |
PATH: map00240 Pyrimidine metabolism |
| PubChem Compound ID |
597 |
| SMILES |
C1=C(NC(=O)N=C1)N |
| Source File Reference |
bmse000180 |
