EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C11H12N2O5 |
| Net Charge | 0 |
| Average Mass | 252.226 |
| Monoisotopic Mass | 252.07462 |
| SMILES | COc1cc(-c2nnc(=O)o2)cc(OC)c1OC |
| InChI | InChI=1S/C11H12N2O5/c1-15-7-4-6(10-12-13-11(14)18-10)5-8(16-2)9(7)17-3/h4-5H,1-3H3,(H,13,14) |
| InChIKey | NOAMAHAIBKUAMA-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-(3,4,5-trimethoxyphenyl)-3H-1,3,4-oxadiazol-2-one (CHEBI:114290) is a methoxybenzenes (CHEBI:51683) |
| Manual Xrefs | Databases |
|---|---|
| LSM-25750 | LINCS |