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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:2,3-dimethylbenzoic acid
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Accession:CHEBI:64823 term browser browse the term
Definition:A dimethylbenzoic acid in which the two methyl groups are located at positions 2 and 3.
Synonyms:related_synonym: 2,3-dimethylbenzenecarboxylic acid;   Formula=C9H10O2;   Hemellitic acid;   InChI=1S/C9H10O2/c1-6-4-3-5-8(7(6)2)9(10)11/h3-5H,1-2H3,(H,10,11);   InChIKey=RIZUCYSQUWMQLX-UHFFFAOYSA-N;   SMILES=Cc1cccc(C(O)=O)c1C
 xref: CAS:603-79-2;   Reaxys:971590
 cyclic_relationship: is_conjugate_acid_of CHEBI:64824

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  CHEBI ontology 0
    role 0
      biological role 0
        antimicrobial agent 0
          antimicrobial food preservative 0
            benzoic acid 0
              2,3-dimethylbenzoic acid 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
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbon oxoacid 0
                                    carboxylic acid 0
                                      aromatic carboxylic acid 0
                                        benzoic acids 0
                                          benzoic acid 0
                                            2,3-dimethylbenzoic acid 0
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