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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:2,5-dimethylbenzoic acid
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Accession:CHEBI:64825 term browser browse the term
Definition:A dimethylbenzoic acid in which the two methyl groups are located at positions 2 and 5.
Synonyms:related_synonym: 2,5-dimethylbenzenecarboxylic acid;   2-carboxy-1,4-dimethylbenzene;   Formula=C9H10O2;   InChI=1S/C9H10O2/c1-6-3-4-7(2)8(5-6)9(10)11/h3-5H,1-2H3,(H,10,11);   InChIKey=XZRHNAFEYMSXRG-UHFFFAOYSA-N;   Isoxylic acid;   SMILES=Cc1ccc(C)c(c1)C(O)=O
 xref: CAS:610-72-0;   Reaxys:971588
 cyclic_relationship: is_conjugate_acid_of CHEBI:64826


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Path 1
Term Annotations click to browse term
  CHEBI ontology 26503
    role 26325
      biological role 26304
        antimicrobial agent 22513
          antimicrobial food preservative 13393
            benzoic acid 6015
              2,5-dimethylbenzoic acid 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 26503
    subatomic particle 26479
      composite particle 26479
        hadron 26479
          baryon 26479
            nucleon 26479
              atomic nucleus 26479
                atom 26479
                  main group element atom 26216
                    p-block element atom 26216
                      carbon group element atom 25661
                        carbon atom 25623
                          organic molecular entity 25623
                            heteroorganic entity 25006
                              organochalcogen compound 24600
                                organooxygen compound 24194
                                  carbon oxoacid 22810
                                    carboxylic acid 22790
                                      aromatic carboxylic acid 13556
                                        benzoic acids 13531
                                          benzoic acid 6015
                                            2,5-dimethylbenzoic acid 0
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