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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:5-methyl-pyrazole-3-carboxylic acid
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Accession:CHEBI:74739 term browser browse the term
Definition:A memebr of the class of pyrazoles that is 1H-pyrazole with methyl and carboxylic acid group substituents at positions 5 and 3 respectively.
Synonyms:exact_synonym: 5-methyl-1H-pyrazole-3-carboxylic acid
 related_synonym: Formula=C5H6N2O2;   InChI=1S/C5H6N2O2/c1-3-2-4(5(8)9)7-6-3/h2H,1H3,(H,6,7)(H,8,9);   InChIKey=WSMQKESQZFQMFW-UHFFFAOYSA-N;   SMILES=Cc1cc(n[nH]1)C(O)=O
 xref: CAS:402-61-9
 xref_mesh: MESH:C005210
 xref: Reaxys:2906


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  CHEBI ontology 494
    role 501
      biological role 494
        biochemical role 454
          metabolite 445
            5-methyl-pyrazole-3-carboxylic acid 0
Path 2
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  CHEBI ontology 494
    subatomic particle 494
      composite particle 494
        hadron 501
          baryon 494
            nucleon 494
              atomic nucleus 494
                atom 494
                  main group element atom 487
                    p-block element atom 487
                      carbon group element atom 476
                        carbon atom 482
                          organic molecular entity 475
                            organic molecule 466
                              organic cyclic compound 449
                                organic heterocyclic compound 419
                                  heteroarene 197
                                    monocyclic heteroarene 171
                                      azole 171
                                        diazole 13
                                          pyrazoles 4
                                            pyrazole 1
                                              1H-pyrazole 1
                                                5-methyl-pyrazole-3-carboxylic acid 0
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