EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H22FN3O2 |
| Net Charge | 0 |
| Average Mass | 367.424 |
| Monoisotopic Mass | 367.16961 |
| SMILES | CCCNC(=O)N1[C@H](C#N)[C@H](c2ccc(-c3ccccc3F)cc2)[C@@H]1CO |
| InChI | InChI=1S/C21H22FN3O2/c1-2-11-24-21(27)25-18(12-23)20(19(25)13-26)15-9-7-14(8-10-15)16-5-3-4-6-17(16)22/h3-10,18-20,26H,2,11,13H2,1H3,(H,24,27)/t18-,19+,20+/m1/s1 |
| InChIKey | NYKFFZXKZNVNOG-AABGKKOBSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (2S,3S,4R)-2-cyano-3-[4-(2-fluorophenyl)phenyl]-4-(hydroxymethyl)-N-propyl-1-azetidinecarboxamide (CHEBI:95474) is a biphenyls (CHEBI:22888) |
| Manual Xrefs | Databases |
|---|---|
| LSM-6853 | LINCS |