EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H16N4O |
| Net Charge | 0 |
| Average Mass | 268.320 |
| Monoisotopic Mass | 268.13241 |
| SMILES | Cc1ccc2oc(Nc3nc(C)c(C)c(C)n3)nc2c1 |
| InChI | InChI=1S/C15H16N4O/c1-8-5-6-13-12(7-8)18-15(20-13)19-14-16-10(3)9(2)11(4)17-14/h5-7H,1-4H3,(H,16,17,18,19) |
| InChIKey | STPKWNFZSPUDJN-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-methyl-N-(4,5,6-trimethyl-2-pyrimidinyl)-1,3-benzoxazol-2-amine (CHEBI:120657) is a benzoxazole (CHEBI:46700) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32099 | LINCS |