EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C25H24F2N4O3S |
| Net Charge | 0 |
| Average Mass | 498.555 |
| Monoisotopic Mass | 498.15372 |
| SMILES | CC=Cc1ccc2n(c1=O)C[C@@H]1[C@@H](CO)[C@H](C(=O)Nc3nccs3)N(Cc3cc(F)ccc3F)[C@H]21 |
| InChI | InChI=1S/C25H24F2N4O3S/c1-2-3-14-4-7-20-21-17(12-30(20)24(14)34)18(13-32)22(23(33)29-25-28-8-9-35-25)31(21)11-15-10-16(26)5-6-19(15)27/h2-10,17-18,21-22,32H,11-13H2,1H3,(H,28,29,33)/t17-,18-,21+,22-/m1/s1 |
| InChIKey | ZDIAMMWGBAVDPO-RPHTVSPISA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-14603 (CHEBI:103259) is a amino acid amide (CHEBI:22475) |
| Manual Xrefs | Databases |
|---|---|
| LSM-14603 | LINCS |