EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C27H23BrN4O2 |
| Net Charge | 0 |
| Average Mass | 515.411 |
| Monoisotopic Mass | 514.10044 |
| SMILES | CC(=O)c1ccc(N2CCN(C(=O)c3cc(-c4cccnc4)nc4ccc(Br)cc34)CC2)cc1 |
| InChI | InChI=1S/C27H23BrN4O2/c1-18(33)19-4-7-22(8-5-19)31-11-13-32(14-12-31)27(34)24-16-26(20-3-2-10-29-17-20)30-25-9-6-21(28)15-23(24)25/h2-10,15-17H,11-14H2,1H3 |
| InChIKey | FQQYAYZCVFCEAZ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-[4-[4-[[6-bromo-2-(3-pyridinyl)-4-quinolinyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone (CHEBI:120987) is a aromatic ketone (CHEBI:76224) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32430 | LINCS |