EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C10H7NO2 |
| Net Charge | 0 |
| Average Mass | 173.171 |
| Monoisotopic Mass | 173.04768 |
| SMILES | O=Cc1cc(=O)c2ccccc2n1 |
| InChI | InChI=1S/C10H7NO2/c12-6-7-5-10(13)8-3-1-2-4-9(8)11-7/h1-6H,(H,11,13) |
| InChIKey | PCPFJNLCUUEVDQ-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | feces (BTO:0000440) | MetaboLights (MTBLS9087) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-Hydroxyquinoline-2-carbaldehyde (CHEBI:231285) is a quinolines (CHEBI:26513) |
| IUPAC Name |
|---|
| 4-oxo-1H-quinoline-2-carbaldehyde |
| Manual Xrefs | Databases |
|---|---|
| 3899141 | ChemSpider |