EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C22H25F3N4O4 |
| Net Charge | 0 |
| Average Mass | 466.460 |
| Monoisotopic Mass | 466.18279 |
| SMILES | O=C(NCC[C@@H]1CC[C@H](NC(=O)c2cccnc2)[C@@H](CO)O1)Nc1ccc(C(F)(F)F)cc1 |
| InChI | InChI=1S/C22H25F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)28-21(32)27-11-9-17-7-8-18(19(13-30)33-17)29-20(31)14-2-1-10-26-12-14/h1-6,10,12,17-19,30H,7-9,11,13H2,(H,29,31)(H2,27,28,32)/t17-,18-,19+/m0/s1 |
| InChIKey | JHFKDWZHMFMOKL-GBESFXJTSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-[[4-(trifluoromethyl)phenyl]carbamoylamino]ethyl]oxan-3-yl]pyridine-3-carboxamide (CHEBI:98385) is a C-glycosyl compound (CHEBI:20857) |
| Manual Xrefs | Databases |
|---|---|
| LSM-9764 | LINCS |