EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C22H30ClFN2O6S2 |
| Net Charge | 0 |
| Average Mass | 537.075 |
| Monoisotopic Mass | 536.12178 |
| SMILES | CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1cccc(Cl)c1 |
| InChI | InChI=1S/C22H30ClFN2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-18(23)12-21)22(32-4)14-25(3)33(28,29)20-10-8-19(24)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22-/m0/s1 |
| InChIKey | KNLROJRONDBMAV-JKSBSHDWSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-chloro-N-[(2S,3R)-4-[(4-fluorophenyl)sulfonyl-methylamino]-3-methoxy-2-methylbutyl]-N-[(2R)-1-hydroxypropan-2-yl]benzenesulfonamide (CHEBI:101066) is a sulfonamide (CHEBI:35358) |
| Manual Xrefs | Databases |
|---|---|
| LSM-12438 | LINCS |