EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C20H22FN3O3 |
| Net Charge | 0 |
| Average Mass | 371.412 |
| Monoisotopic Mass | 371.16452 |
| SMILES | CN(C)C(=O)[C@@H]1N[C@@H]2c3ccc(-c4ccc(F)cc4)c(=O)n3C[C@@H]2[C@H]1CO |
| InChI | InChI=1S/C20H22FN3O3/c1-23(2)20(27)18-15(10-25)14-9-24-16(17(14)22-18)8-7-13(19(24)26)11-3-5-12(21)6-4-11/h3-8,14-15,17-18,22,25H,9-10H2,1-2H3/t14-,15-,17+,18-/m1/s1 |
| InChIKey | HRNJAQRGDGXKJI-XYVMCAHJSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (2R,3R,3aS,9bS)-7-(4-fluorophenyl)-3-(hydroxymethyl)-N,N-dimethyl-6-oxo-1,2,3,3a,4,9b-hexahydropyrrolo[2,3-a]indolizine-2-carboxamide (CHEBI:100599) is a phenylpyridine (CHEBI:38193) |
| Manual Xrefs | Databases |
|---|---|
| LSM-11973 | LINCS |