EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H30F2N4O5 |
| Net Charge | 0 |
| Average Mass | 468.501 |
| Monoisotopic Mass | 468.21843 |
| SMILES | O=C(C[C@H]1C=C[C@H](NC(=O)Nc2cc(F)ccc2F)[C@H](CO)O1)NCCCN1CCOCC1 |
| InChI | InChI=1S/C22H30F2N4O5/c23-15-2-4-17(24)19(12-15)27-22(31)26-18-5-3-16(33-20(18)14-29)13-21(30)25-6-1-7-28-8-10-32-11-9-28/h2-5,12,16,18,20,29H,1,6-11,13-14H2,(H,25,30)(H2,26,27,31)/t16-,18+,20+/m1/s1 |
| InChIKey | BZALQHWMPIGLLK-KPFFTGBYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[(2R,3S,6S)-3-[[(2,5-difluoroanilino)-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]-N-[3-(4-morpholinyl)propyl]acetamide (CHEBI:118570) is a ureas (CHEBI:47857) |
| Manual Xrefs | Databases |
|---|---|
| LSM-30019 | LINCS |