EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H28FN3O5S |
| Net Charge | 0 |
| Average Mass | 489.569 |
| Monoisotopic Mass | 489.17337 |
| SMILES | C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2ncc(C#Cc3cccc(F)c3)cc2C1=O |
| InChI | InChI=1S/C24H28FN3O5S/c1-16-13-28(17(2)15-29)24(30)21-11-19(9-8-18-6-5-7-20(25)10-18)12-26-23(21)33-22(16)14-27(3)34(4,31)32/h5-7,10-12,16-17,22,29H,13-15H2,1-4H3/t16-,17+,22-/m0/s1 |
| InChIKey | XOGNINPAOVJVSL-JKSBSHDWSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[[(2R,3S)-8-[2-(3-fluorophenyl)ethynyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylmethanesulfonamide (CHEBI:106240) is a organofluorine compound (CHEBI:37143) |
| Manual Xrefs | Databases |
|---|---|
| LSM-17601 | LINCS |