EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C31H23BrO2S |
| Net Charge | 0 |
| Average Mass | 539.494 |
| Monoisotopic Mass | 538.06021 |
| SMILES | O=c1sc2ccccc2c(O)c1C1CC(c2ccc(-c3ccc(Br)cc3)cc2)Cc2ccccc21 |
| InChI | InChI=1S/C31H23BrO2S/c32-24-15-13-20(14-16-24)19-9-11-21(12-10-19)23-17-22-5-1-2-6-25(22)27(18-23)29-30(33)26-7-3-4-8-28(26)35-31(29)34/h1-16,23,27,33H,17-18H2 |
| InChIKey | JHELOZJAKXYVBE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Difethialone (CHEBI:81893) is a benzenes (CHEBI:22712) |
| Difethialone (CHEBI:81893) is a naphthalenes (CHEBI:25477) |
| Difethialone (CHEBI:81893) is a ring assembly (CHEBI:36820) |