EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C20H24ClN3O5S |
| Net Charge | 0 |
| Average Mass | 453.948 |
| Monoisotopic Mass | 453.11252 |
| SMILES | O=C(N[C@H]1CC[C@@H](CCNS(=O)(=O)c2cccc(Cl)c2)O[C@H]1CO)c1ccncc1 |
| InChI | InChI=1S/C20H24ClN3O5S/c21-15-2-1-3-17(12-15)30(27,28)23-11-8-16-4-5-18(19(13-25)29-16)24-20(26)14-6-9-22-10-7-14/h1-3,6-7,9-10,12,16,18-19,23,25H,4-5,8,11,13H2,(H,24,26)/t16-,18-,19-/m0/s1 |
| InChIKey | ZGRBCZVMEMXSST-WDSOQIARSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2R,3S,6S)-6-[2-[(3-chlorophenyl)sulfonylamino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-4-pyridinecarboxamide (CHEBI:118925) is a C-glycosyl compound (CHEBI:20857) |
| Manual Xrefs | Databases |
|---|---|
| LSM-30374 | LINCS |