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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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    • Term paths to the root
    Path 1
    Term Annotations click to browse term
      CHEBI ontology 19831
        role 19807
          biological role 19805
            aetiopathogenetic role 19180
              carcinogenic agent 18502
                benzo[a]pyrene 16070
                  7,8-dihydro-7-hydroxy-8S-glutathionylbenzo[a]pyrene 0
                  benzo[a]pyrene diol epoxide I 3308
                  benzo[a]pyrene-7,8-dione 18
    Path 2
    Term Annotations click to browse term
      CHEBI ontology 19831
        subatomic particle 19829
          composite particle 19829
            hadron 19829
              baryon 19829
                nucleon 19829
                  atomic nucleus 19829
                    atom 19829
                      main group element atom 19779
                        main group molecular entity 19779
                          s-block molecular entity 19617
                            hydrogen molecular entity 19604
                              hydrides 19102
                                organic hydride 18674
                                  organic fundamental parent 18674
                                    hydrocarbon 18410
                                      cyclic hydrocarbon 17225
                                        arene 17205
                                          polycyclic arene 17035
                                            ortho- and peri-fused polycyclic arene 16286
                                              benzo[a]pyrene 16070
                                                7,8-dihydro-7-hydroxy-8S-glutathionylbenzo[a]pyrene 0
                                                benzo[a]pyrene diol epoxide I 3308
                                                benzo[a]pyrene-7,8-dione 18
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