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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:benzo[a]pyrene
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Accession:CHEBI:29865 term browser browse the term
Definition:An ortho- and peri-fused polycyclic arene consisting of five fused benzene rings.
Synonyms:exact_synonym: benzo[pqr]tetraphene
 related_synonym: (B(a)P);   3,4-BP;   3,4-Benzopyrene;   3,4-Benzpyrene;   BP;   Benzpyrene;   Formula=C20H12;   InChI=1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H;   InChIKey=FMMWHPNWAFZXNH-UHFFFAOYSA-N;   SMILES=c1ccc2c(c1)cc1ccc3cccc4ccc2c1c34;   benzo[def]chrysene
 alt_id: CHEBI:22716;   CHEBI:3045
 xref: Beilstein:1911333;   CAS:50-32-8;   Gmelin:262573;   KEGG:C07535;   LINCS:LSM-2198
 xref_mesh: MESH:D001564
 xref: PMID:11932001;   PMID:16256111;   PMID:16381670;   PMID:1844333;   PMID:26530167;   PMID:26703252;   PMID:7561049;   PMID:7721048;   Reaxys:1911333;   Wikipedia:Benzo(a)pyrene


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19791
    role 19738
      biological role 19738
        aetiopathogenetic role 18935
          carcinogenic agent 18308
            benzo[a]pyrene 15924
              7,8-dihydro-7-hydroxy-8S-glutathionylbenzo[a]pyrene 0
              benzo[a]pyrene diol epoxide I 3262
              benzo[a]pyrene-7,8-dione 18
Path 2
Term Annotations click to browse term
  CHEBI ontology 19791
    subatomic particle 19788
      composite particle 19788
        hadron 19788
          baryon 19788
            nucleon 19788
              atomic nucleus 19788
                atom 19788
                  main group element atom 19676
                    main group molecular entity 19676
                      s-block molecular entity 19434
                        hydrogen molecular entity 19424
                          hydrides 18687
                            organic hydride 18248
                              organic fundamental parent 18248
                                hydrocarbon 17969
                                  cyclic hydrocarbon 17058
                                    arene 17054
                                      polycyclic arene 16873
                                        ortho- and peri-fused polycyclic arene 16145
                                          benzo[a]pyrene 15924
                                            7,8-dihydro-7-hydroxy-8S-glutathionylbenzo[a]pyrene 0
                                            benzo[a]pyrene diol epoxide I 3262
                                            benzo[a]pyrene-7,8-dione 18
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