EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C25H20N4O3 |
| Net Charge | 0 |
| Average Mass | 424.460 |
| Monoisotopic Mass | 424.15354 |
| SMILES | COc1ccc(C=NNC(=O)c2nc(-c3ccccc3)cc(-c3ccccc3)n2)cc1O |
| InChI | InChI=1S/C25H20N4O3/c1-32-23-13-12-17(14-22(23)30)16-26-29-25(31)24-27-20(18-8-4-2-5-9-18)15-21(28-24)19-10-6-3-7-11-19/h2-16,30H,1H3,(H,29,31) |
| InChIKey | IZCIIXYLFYRZPN-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(3-hydroxy-4-methoxyphenyl)methylideneamino]-4,6-diphenyl-2-pyrimidinecarboxamide (CHEBI:107070) is a pyrimidines (CHEBI:39447) |
| Manual Xrefs | Databases |
|---|---|
| LSM-18424 | LINCS |