EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C20H17F2N3O3 |
| Net Charge | 0 |
| Average Mass | 385.370 |
| Monoisotopic Mass | 385.12380 |
| SMILES | O=C(O)c1cn(-c2ccc(F)cc2)c2cc(N3CCNCC3)c(F)cc2c1=O |
| InChI | InChI=1S/C20H17F2N3O3/c21-12-1-3-13(4-2-12)25-11-15(20(27)28)19(26)14-9-16(22)18(10-17(14)25)24-7-5-23-6-8-24/h1-4,9-11,23H,5-8H2,(H,27,28) |
| InChIKey | XBHBWNFJWIASRO-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-fluoro-1-(4-fluorophenyl)-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid (CHEBI:94493) is a quinolines (CHEBI:26513) |
| Manual Xrefs | Databases |
|---|---|
| LSM-5263 | LINCS |
| 1744 | VSDB |
| HMDB0039526 | HMDB |