EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H36ClN3O3S |
| Net Charge | 0 |
| Average Mass | 470.079 |
| Monoisotopic Mass | 469.21659 |
| SMILES | CCCCC1CCC(C(=O)NCCS(=O)(=O)N2CCN(c3cccc(Cl)c3)CC2)CC1 |
| InChI | InChI=1S/C23H36ClN3O3S/c1-2-3-5-19-8-10-20(11-9-19)23(28)25-12-17-31(29,30)27-15-13-26(14-16-27)22-7-4-6-21(24)18-22/h4,6-7,18-20H,2-3,5,8-17H2,1H3,(H,25,28) |
| InChIKey | BEQFSSMENHBAAH-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| S1QEL2.2 (CHEBI:747478) is a organic molecular entity (CHEBI:50860) |
| Registry Numbers | Sources |
|---|---|
| CAS:951535-81-2 | CAS |