EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H12N2O2 |
| Net Charge | 0 |
| Average Mass | 216.240 |
| Monoisotopic Mass | 216.08988 |
| SMILES | Cc1cc(C)c2c(c1O)NC(=CN=O)C=C2 |
| InChI | InChI=1S/C12H12N2O2/c1-7-5-8(2)12(15)11-10(7)4-3-9(14-11)6-13-16/h3-6,14-15H,1-2H3 |
| InChIKey | VTAKVWTYYMXXOT-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5,7-dimethyl-2-(nitrosomethylidene)-1H-quinolin-8-ol (CHEBI:107518) is a quinolines (CHEBI:26513) |
| Manual Xrefs | Databases |
|---|---|
| LSM-18874 | LINCS |