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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:triclosan
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Accession:CHEBI:164200 term browser browse the term
Definition:An aromatic ether that is phenol which is substituted at C-5 by a chloro group and at C-2 by a 2,4-dichlorophenoxy group. It is widely used as a preservative and antimicrobial agent in personal care products such as soaps, skin creams, toothpaste and deodorants as well as in household items such as plastic chopping boards, sports equipment and shoes.
Synonyms:exact_synonym: 5-chloro-2-(2,4-dichlorophenoxy)phenol
 related_synonym: 2,4,4'-Trichloro-2'-hydroxydiphenyl ether;   5-Chloro-2-(2,4-dichloro-phenoxy)-phenol;   Formula=C12H7Cl3O2;   InChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H;   InChIKey=XEFQLINVKFYRCS-UHFFFAOYSA-N;   SMILES=Oc1cc(Cl)ccc1Oc1ccc(Cl)cc1Cl;   triclosanum
 alt_id: CHEBI:29697;   CHEBI:47700
 xref: Beilstein:2057142;   CAS:3380-34-5;   DrugBank:DB08604;   Drug_Central:3631;   KEGG:C12059;   KEGG:D06226;   LINCS:LSM-2929
 xref_mesh: MESH:D014260
 xref: PDBeChem:TCL;   PMID:11175846;   PMID:11418506;   PMID:15269185;   PMID:17567585;   PMID:18837732;   PMID:18937596;   PMID:19388793;   PMID:21094257;   PMID:21166831;   PMID:21833630;   PMID:22105314;   PMID:22561896;   PMID:22746545;   PMID:23146048;   PMID:23161706;   PMID:23192912;   PMID:23282071;   PMID:23313217;   PMID:23320506;   PMID:23368947;   PMID:23435526;   PMID:23561013;   PMID:23592331;   PMID:23614034;   PMID:23648333;   PMID:23791346;   PMID:23831729;   PMID:23890965;   PMID:23927454;   PMID:24079913;   PMID:25179274;   PMID:28236114;   PMID:28339349;   PMID:28632490;   PMID:28741979;   PMID:29030459;   PMID:29067681;   PMID:29100157;   PMID:29109308;   PMID:29111213;   PMID:29111444;   PMID:29131715;   PMID:29150338;   PMID:29154092;   PMID:29172042;   PMID:29175687;   PMID:29197580;   PMID:29205483;   PMID:29214481;   PMID:29232866;   PMID:29277667;   PMID:29332277;   PMID:29340711;   PMID:29348637;   Patent:NL6401526;   Patent:US3506720;   Patent:US3629477;   Reaxys:2057142;   Wikipedia:Triclosan


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    Path 1
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      CHEBI ontology 19876
        role 19851
          biological role 19849
            xenobiotic 18740
              triclosan 2106
    Path 2
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      CHEBI ontology 19876
        subatomic particle 19874
          composite particle 19874
            hadron 19874
              baryon 19874
                nucleon 19874
                  atomic nucleus 19905
                    atom 19905
                      main group element atom 19821
                        p-block element atom 19821
                          carbon group element atom 19768
                            carbon atom 19764
                              organic molecular entity 19764
                                organic molecule 19721
                                  organic cyclic compound 19526
                                    carbocyclic compound 18571
                                      benzenoid aromatic compound 17954
                                        benzenes 17773
                                          chlorobenzenes 14823
                                            dichlorobenzene 11529
                                              triclosan 2106
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