EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H24ClN5O4S |
| Net Charge | 0 |
| Average Mass | 477.974 |
| Monoisotopic Mass | 477.12375 |
| SMILES | O=S(=O)(N[C@H]1CC[C@H](CCn2cc(-c3ccccn3)nn2)O[C@H]1CO)c1cccc(Cl)c1 |
| InChI | InChI=1S/C21H24ClN5O4S/c22-15-4-3-5-17(12-15)32(29,30)25-19-8-7-16(31-21(19)14-28)9-11-27-13-20(24-26-27)18-6-1-2-10-23-18/h1-6,10,12-13,16,19,21,25,28H,7-9,11,14H2/t16-,19+,21+/m1/s1 |
| InChIKey | KSHGYKMGUCEKKM-PBEJRMEISA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-chloro-N-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-[4-(2-pyridinyl)-1-triazolyl]ethyl]-3-oxanyl]benzenesulfonamide (CHEBI:118006) is a C-glycosyl compound (CHEBI:20857) |
| Manual Xrefs | Databases |
|---|---|
| LSM-29455 | LINCS |