EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C26H32F3N3O5S |
| Net Charge | 0 |
| Average Mass | 555.619 |
| Monoisotopic Mass | 555.20148 |
| SMILES | CC=Cc1ccc2c(c1)O[C@H](CN(C)C(=O)Nc1ccc(C(F)(F)F)cc1)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O |
| InChI | InChI=1S/C26H32F3N3O5S/c1-5-6-19-7-12-24-22(13-19)37-23(17(2)14-32(18(3)16-33)38(24,35)36)15-31(4)25(34)30-21-10-8-20(9-11-21)26(27,28)29/h5-13,17-18,23,33H,14-16H2,1-4H3,(H,30,34)/t17-,18-,23+/m0/s1 |
| InChIKey | LTKMQPAAUJNDJU-IUKKYPGJSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-41295 (CHEBI:129744) is a ureas (CHEBI:47857) |
| Manual Xrefs | Databases |
|---|---|
| LSM-41295 | LINCS |