EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:123604 - N-[(2R,3S,6S)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]propanamide
| Formula | C18H23FN2O4 |
| Net Charge | 0 |
| Average Mass | 350.390 |
| Monoisotopic Mass | 350.16419 |
| SMILES | CCC(=O)N[C@H]1C=C[C@H](CC(=O)NCc2ccccc2F)O[C@H]1CO |
| InChI | InChI=1S/C18H23FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-8,13,15-16,22H,2,9-11H2,1H3,(H,20,24)(H,21,23)/t13-,15+,16+/m1/s1 |
| InChIKey | DLMKWWGZUXJMAT-KBMXLJTQSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2R,3S,6S)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]propanamide (CHEBI:123604) is a organofluorine compound (CHEBI:37143) |
| Manual Xrefs | Databases |
|---|---|
| LSM-35046 | LINCS |