EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C25H25N5O2 |
| Net Charge | 0 |
| Average Mass | 427.508 |
| Monoisotopic Mass | 427.20083 |
| SMILES | COc1ccc(-c2cc3nc(-c4ccccc4)cc(N4CCN(C(C)=O)CC4)n3n2)cc1 |
| InChI | InChI=1S/C25H25N5O2/c1-18(31)28-12-14-29(15-13-28)25-17-22(19-6-4-3-5-7-19)26-24-16-23(27-30(24)25)20-8-10-21(32-2)11-9-20/h3-11,16-17H,12-15H2,1-2H3 |
| InChIKey | APQIVKLWLHXSLW-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-[4-[2-(4-methoxyphenyl)-5-phenyl-7-pyrazolo[1,5-a]pyrimidinyl]-1-piperazinyl]ethanone (CHEBI:93679) is a pyrimidines (CHEBI:39447) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4157 | LINCS |