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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polybromodiphenyl ether that is diphenyl ether in which the hydrogens at the 2, 4, 5, 2', and 4' positions have been replaced by bromines.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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    • Term paths to the root
    Path 1
    Term Annotations click to browse term
      CHEBI ontology 19874
        role 19844
          application 19689
            flame retardant 10552
              brominated flame retardant 4888
                polybromodiphenyl ether 4131
                  2,4-dibromophenyl 2,4,5-tribromophenyl ether 2253
    Path 2
    Term Annotations click to browse term
      CHEBI ontology 19874
        subatomic particle 19872
          composite particle 19872
            hadron 19872
              baryon 19872
                nucleon 19872
                  atomic nucleus 19872
                    atom 19872
                      main group element atom 19811
                        p-block element atom 19811
                          carbon group element atom 19751
                            carbon atom 19748
                              organic molecular entity 19748
                                organic molecule 19700
                                  organic cyclic compound 19490
                                    carbocyclic compound 18579
                                      benzenoid aromatic compound 18003
                                        benzenes 17868
                                          bromobenzenes 5126
                                            polybromodiphenyl ether 4131
                                              2,4-dibromophenyl 2,4,5-tribromophenyl ether 2253
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