EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H26ClN3O5S |
| Net Charge | 0 |
| Average Mass | 467.975 |
| Monoisotopic Mass | 467.12817 |
| SMILES | O=C(Cc1ccncc1)NCC[C@@H]1CC[C@@H](NS(=O)(=O)c2ccccc2Cl)[C@H](CO)O1 |
| InChI | InChI=1S/C21H26ClN3O5S/c22-17-3-1-2-4-20(17)31(28,29)25-18-6-5-16(30-19(18)14-26)9-12-24-21(27)13-15-7-10-23-11-8-15/h1-4,7-8,10-11,16,18-19,25-26H,5-6,9,12-14H2,(H,24,27)/t16-,18+,19-/m0/s1 |
| InChIKey | TUNGNDZZYYVKEI-UHOSZYNNSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[2-[(2S,5R,6R)-5-[(2-chlorophenyl)sulfonylamino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-pyridin-4-ylacetamide (CHEBI:122320) is a C-glycosyl compound (CHEBI:20857) |
| Manual Xrefs | Databases |
|---|---|
| LSM-33763 | LINCS |