EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C25H24FN3O2 |
| Net Charge | 0 |
| Average Mass | 417.484 |
| Monoisotopic Mass | 417.18526 |
| SMILES | O=C(Cc1ccncc1)N1CC[C@@H]2[C@H]1c1cc(-c3ccccc3F)ccc1N[C@@H]2CO |
| InChI | InChI=1S/C25H24FN3O2/c26-21-4-2-1-3-18(21)17-5-6-22-20(14-17)25-19(23(15-30)28-22)9-12-29(25)24(31)13-16-7-10-27-11-8-16/h1-8,10-11,14,19,23,25,28,30H,9,12-13,15H2/t19-,23+,25-/m0/s1 |
| InChIKey | FYKRKSAHPADLCF-CYSDGLOUSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-[(3aS,4S,9bS)-8-(2-fluorophenyl)-4-(hydroxymethyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-2-pyridin-4-ylethanone (CHEBI:128522) is a quinolines (CHEBI:26513) |
| Manual Xrefs | Databases |
|---|---|
| LSM-40076 | LINCS |