EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C16H25ClN2O6S2 |
| Net Charge | 0 |
| Average Mass | 440.971 |
| Monoisotopic Mass | 440.08426 |
| SMILES | CCS(=O)(=O)NCC[C@@H]1CC[C@@H](NS(=O)(=O)c2cccc(Cl)c2)[C@@H](CO)O1 |
| InChI | InChI=1S/C16H25ClN2O6S2/c1-2-26(21,22)18-9-8-13-6-7-15(16(11-20)25-13)19-27(23,24)14-5-3-4-12(17)10-14/h3-5,10,13,15-16,18-20H,2,6-9,11H2,1H3/t13-,15+,16+/m0/s1 |
| InChIKey | PCAWZXQDZTWTAN-NUEKZKHPSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-chloro-N-[(2S,3R,6S)-6-[2-(ethylsulfonylamino)ethyl]-2-(hydroxymethyl)-3-oxanyl]benzenesulfonamide (CHEBI:118598) is a C-glycosyl compound (CHEBI:20857) |
| Manual Xrefs | Databases |
|---|---|
| LSM-30047 | LINCS |