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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:itaconic acid
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Accession:CHEBI:30838 term browser browse the term
Definition:A dicarboxylic acid that is methacrylic acid in which one of the methyl hydrogens is substituted by a carboxylic acid group.
Synonyms:related_synonym: 2-methylenesuccinic acid;   2-methylidenebutanedioic acid;   2-propene-1,2-dicarboxylic acid;   Formula=C5H6O4;   InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h1-2H2,(H,6,7)(H,8,9);   InChIKey=LVHBHZANLOWSRM-UHFFFAOYSA-N;   Methylenesuccinic acid;   SMILES=C(C(CC(O)=O)=C)(O)=O;   methylenebutanedioic acid;   propylenedicarboxylic acid
 alt_id: CHEBI:24933;   CHEBI:6074
 xref: CAS:97-65-4;   ECMDB:ECMDB02092;   Gmelin:240640;   HMDB:HMDB0002092;   KEGG:C00490;   KNApSAcK:C00033964;   LIPID_MAPS_instance:LMFA01170063;   MetaCyc:ITACONATE;   PMID:18584171;   PMID:23420787;   PMID:23610393;   PMID:24169454;   Reaxys:1759501;   Wikipedia:Itaconic_acid;   YMDB:YMDB00716
 cyclic_relationship: is_conjugate_acid_of CHEBI:17240


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Path 1
Term Annotations click to browse term
  CHEBI ontology 5163
    role 5116
      application 909
        pharmaceutical 738
          drug 744
            anti-ulcer drug 24
              succinic acid 22
                itaconic acid 0
                  tensyuic acid + 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 5163
    subatomic particle 5140
      composite particle 5154
        hadron 5154
          baryon 5154
            nucleon 5154
              atomic nucleus 5154
                atom 5154
                  main group element atom 5113
                    p-block element atom 5110
                      carbon group element atom 5028
                        carbon atom 5027
                          organic molecular entity 5027
                            heteroorganic entity 4873
                              organochalcogen compound 4827
                                organooxygen compound 4791
                                  carbon oxoacid 393
                                    carboxylic acid 389
                                      monocarboxylic acid 228
                                        fatty acid 131
                                          fatty acid derivative 91
                                            dicarboxylic fatty acid 0
                                              itaconic acid 0
                                                tensyuic acid + 0
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