EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C9H12N2O2 |
| Net Charge | 0 |
| Average Mass | 180.207 |
| Monoisotopic Mass | 180.08988 |
| SMILES | CCOc1ccc(NC(N)=O)cc1 |
| InChI | InChI=1S/C9H12N2O2/c1-2-13-8-5-3-7(4-6-8)11-9(10)12/h3-6H,2H2,1H3,(H3,10,11,12) |
| InChIKey | GGLIEWRLXDLBBF-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Dulcin (CHEBI:82462) is a ureas (CHEBI:47857) |
| Manual Xrefs | Databases |
|---|---|
| C19415 | KEGG COMPOUND |
| HMDB0032565 | HMDB |
| Registry Numbers | Sources |
|---|---|
| CAS:150-69-6 | KEGG COMPOUND |