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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:3-methylvaleric acid
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Accession:CHEBI:166883 term browser browse the term
Definition:A methyl-branched fatty acid that is pentanoic acid which carries a methyl group at position 3.
Synonyms:exact_synonym: 3-methylpentanoic acid
 related_synonym: 2-methylbutane-1-carboxylic acid;   3-ethylbutanoic acid;   3-methyl-n-valeric acid;   3-methyl-pentanoic acid;   Formula=C6H12O2;   InChI=1S/C6H12O2/c1-3-5(2)4-6(7)8/h5H,3-4H2,1-2H3,(H,7,8);   InChIKey=IGIDLTISMCAULB-UHFFFAOYSA-N;   SMILES=CCC(C)CC(O)=O;   beta-methylvaleric acid
 xref: CAS:105-43-1;   FooDB:FDB012545;   HMDB:HMDB0033774;   LIPID_MAPS_instance:LMFA01020075;   PMID:26332370;   PMID:29732495;   PMID:31591212;   PMID:32512824;   PMID:32640344;   PMID:32846567;   PMID:6487265;   Reaxys:1720696
 cyclic_relationship: is_conjugate_acid_of CHEBI:167610


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Path 1
Term Annotations click to browse term
  CHEBI ontology 22194
    role 22179
      application 21760
        food additive 17239
          flavouring agent 4675
            3-methylvaleric acid 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 22194
    subatomic particle 22186
      composite particle 22186
        hadron 22186
          baryon 22186
            nucleon 22186
              atomic nucleus 22186
                atom 22186
                  main group element atom 22120
                    p-block element atom 22120
                      carbon group element atom 21920
                        carbon atom 21846
                          organic molecular entity 21846
                            heteroorganic entity 21500
                              organochalcogen compound 20983
                                organooxygen compound 20824
                                  carbon oxoacid 19606
                                    carboxylic acid 19602
                                      monocarboxylic acid 18969
                                        fatty acid 17131
                                          saturated fatty acid 16850
                                            branched-chain saturated fatty acid 15488
                                              3-methylvaleric acid 0
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