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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-di-tert-butylphenol
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Accession:CHEBI:89188 term browser browse the term
Definition:A member of the class of phenols carrying two tert-butyl substituents at positions 2 and 4.
Synonyms:related_synonym: 1-Hydroxy-2,4-di-tert-butylbenzene;   2,4-Bis(1,1-dimethylethyl)phenol;   2,4-Bis(tert-butyl)phenol;   2,4-Di-t-Butylphenol;   2,4-Tert-butylphenol;   Formula=C14H22O;   InChI=1S/C14H22O/c1-13(2,3)10-7-8-12(15)11(9-10)14(4,5)6/h7-9,15H,1-6H3;   InChIKey=ICKWICRCANNIBI-UHFFFAOYSA-N;   SMILES=OC1=CC=C(C(C)(C)C)C=C1C(C)(C)C
 xref: Beilstein:1910383;   CAS:96-76-4;   HMDB:HMDB0013816
 xref_mesh: MESH:C056559
 xref: PMID:16595909;   PMID:22020168;   PMID:23450232;   PMID:24074359;   PMID:24934765;   PMID:25641715;   PMID:27107984;   PMID:27524650;   Reaxys:1910383

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  CHEBI ontology 0
    role 0
      chemical role 0
        antioxidant 0
          2,4-di-tert-butylphenol 0
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    main group molecular entity 0
                      s-block molecular entity 0
                        hydrogen molecular entity 0
                          hydrides 0
                            organic hydride 0
                              organic fundamental parent 0
                                hydrocarbon 0
                                  cyclic hydrocarbon 0
                                    monocyclic hydrocarbon 0
                                      annulene 0
                                        aromatic annulene 0
                                          benzene 0
                                            alkylbenzene 0
                                              2,4-di-tert-butylphenol 0
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