EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C8H6N2O3 |
| Net Charge | 0 |
| Average Mass | 178.147 |
| Monoisotopic Mass | 178.03784 |
| SMILES | O=C1NC(=O)C(=Cc2ccco2)N1 |
| InChI | InChI=1S/C8H6N2O3/c11-7-6(9-8(12)10-7)4-5-2-1-3-13-5/h1-4H,(H2,9,10,11,12) |
| InChIKey | NTRZCUHJPUNEDE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-(2-furanylmethylidene)imidazolidine-2,4-dione (CHEBI:93648) is a imidazolidine-2,4-dione (CHEBI:24628) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4118 | LINCS |