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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
Term:2,4-dibromophenyl 2,4,5-tribromophenyl ether
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Accession:CHEBI:81582 term browser browse the term
Definition:A polybromodiphenyl ether that is diphenyl ether in which the hydrogens at the 2, 4, 5, 2', and 4' positions have been replaced by bromines.
Synonyms:related_synonym: 1,2,4-tribromo-5-(2,4-dibromophenoxy)benzene;   2,2',4,4',5-pentabromodiphenyl ether;   BDE 99;   Formula=C12H5Br5O;   InChI=1S/C12H5Br5O/c13-6-1-2-11(9(16)3-6)18-12-5-8(15)7(14)4-10(12)17/h1-5H;   InChIKey=WHPVYXDFIXRKLN-UHFFFAOYSA-N;   PBDE 99;   SMILES=O(C=1C=C(C(=CC1Br)Br)Br)C=2C=CC(=CC2Br)Br
 alt_id: MESH:C477694
 xref: CAS:60348-60-9;   HMDB:HMDB0037516;   KEGG:C18203
 xref_mesh: MESH:C477694
 xref: PMID:23258742;   PMID:25081382;   PMID:25747361;   PMID:25908029;   PMID:25956475;   PMID:26505652;   PMID:26923239;   PMID:27343407;   PMID:27471519;   PMID:28006665;   PMID:28007175;   PMID:28034496;   PMID:28104345;   PMID:28317842;   PMID:28512710;   PMID:28525869;   PMID:28557710;   Reaxys:7538447


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Path 1
Term Annotations click to browse term
  CHEBI ontology 5151
    role 5118
      application 905
        flame retardant 22
          brominated flame retardant 22
            polybromodiphenyl ether 0
              2,4-dibromophenyl 2,4,5-tribromophenyl ether 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 5151
    subatomic particle 5142
      composite particle 5142
        hadron 5142
          baryon 5142
            nucleon 5142
              atomic nucleus 5142
                atom 5142
                  main group element atom 5115
                    p-block element atom 5112
                      carbon group element atom 5030
                        carbon atom 5029
                          organic molecular entity 5029
                            organic molecule 4978
                              organic cyclic compound 4919
                                carbocyclic compound 267
                                  benzenoid aromatic compound 237
                                    benzenes 230
                                      bromobenzenes 2
                                        polybromodiphenyl ether 0
                                          2,4-dibromophenyl 2,4,5-tribromophenyl ether 0
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