EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H25FN4O4S |
| Net Charge | 0 |
| Average Mass | 424.498 |
| Monoisotopic Mass | 424.15805 |
| SMILES | O=S(=O)(N[C@@H]1CC[C@H](CCn2cc(C3CC3)nn2)O[C@H]1CO)c1ccc(F)cc1 |
| InChI | InChI=1S/C19H25FN4O4S/c20-14-3-6-16(7-4-14)29(26,27)22-17-8-5-15(28-19(17)12-25)9-10-24-11-18(21-23-24)13-1-2-13/h3-4,6-7,11,13,15,17,19,22,25H,1-2,5,8-10,12H2/t15-,17-,19+/m1/s1 |
| InChIKey | DBHQDXKAYSPQOJ-SUMDDJOVSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2R,3R,6R)-6-[2-(4-cyclopropyl-1-triazolyl)ethyl]-2-(hydroxymethyl)-3-oxanyl]-4-fluorobenzenesulfonamide (CHEBI:118784) is a C-glycosyl compound (CHEBI:20857) |
| Manual Xrefs | Databases |
|---|---|
| LSM-30233 | LINCS |