EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C12H3Cl7O |
| Net Charge | 0 |
| Average Mass | 411.326 |
| Monoisotopic Mass | 407.80036 |
| SMILES | Oc1c(Cl)c(Cl)c(-c2cc(Cl)c(Cl)cc2Cl)c(Cl)c1Cl |
| InChI | InChI=1S/C12H3Cl7O/c13-4-2-6(15)5(14)1-3(4)7-8(16)10(18)12(20)11(19)9(7)17/h1-2,20H |
| InChIKey | RPXRFGDJHIVRSM-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-Hydroxy-2,2',3,4',5,5',6-heptachlorobiphenyl (CHEBI:34415) is a biphenyls (CHEBI:22888) |
| 4-Hydroxy-2,2',3,4',5,5',6-heptachlorobiphenyl (CHEBI:34415) is a tetrachlorobenzene (CHEBI:26888) |
| 4-Hydroxy-2,2',3,4',5,5',6-heptachlorobiphenyl (CHEBI:34415) is a trichlorobenzene (CHEBI:27096) |
| Synonyms | Source |
|---|---|
| 2,2',3,4',5,5',6-Heptachloro-4-biphenylol | KEGG COMPOUND |
| 4-Hydroxy-2,2',3,4',5,5',6-heptachlorobiphenyl | KEGG COMPOUND |
| 4-Hydroxy-PCB 187 | KEGG COMPOUND |
| Manual Xrefs | Databases |
|---|---|
| C14382 | KEGG COMPOUND |
| Registry Numbers | Sources |
|---|---|
| CAS:158076-68-7 | KEGG COMPOUND |