EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H22FN3O2 |
| Net Charge | 0 |
| Average Mass | 367.424 |
| Monoisotopic Mass | 367.16961 |
| SMILES | CC(C)NC(=O)N1[C@@H](C#N)[C@H](c2ccc(-c3ccc(F)cc3)cc2)[C@@H]1CO |
| InChI | InChI=1S/C21H22FN3O2/c1-13(2)24-21(27)25-18(11-23)20(19(25)12-26)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15/h3-10,13,18-20,26H,12H2,1-2H3,(H,24,27)/t18-,19-,20-/m0/s1 |
| InChIKey | GQNJFXBZXQABNJ-UFYCRDLUSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (2R,3S,4R)-2-cyano-3-[4-(4-fluorophenyl)phenyl]-4-(hydroxymethyl)-N-propan-2-yl-1-azetidinecarboxamide (CHEBI:103100) is a biphenyls (CHEBI:22888) |
| Manual Xrefs | Databases |
|---|---|
| LSM-14445 | LINCS |