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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-methylvaleric acid
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Accession:CHEBI:167644 term browser browse the term
Definition:A methyl-branched fatty acid that is pentanoic acid which carries a methyl group at position 2.
Synonyms:exact_synonym: 2-methylpentanoic acid
 related_synonym: 2-methyl-n-valeric acid;   2-pentanecarboxylic acid;   FEMA 2754;   Formula=C6H12O2;   InChI=1S/C6H12O2/c1-3-4-5(2)6(7)8/h5H,3-4H2,1-2H3,(H,7,8);   InChIKey=OVBFMEVBMNZIBR-UHFFFAOYSA-N;   SMILES=CCCC(C)C(O)=O;   alpha-methylvaleric acid;   methylpropylacetic acid
 xref: CAS:97-61-0;   Chemspider:7064;   FooDB:FDB008203;   LIPID_MAPS_instance:LMFA01020074;   PMID:20860033;   PMID:29935244;   PMID:7630382;   PMID:869521;   Reaxys:1720658
 cyclic_relationship: is_conjugate_acid_of CHEBI:167611


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    subatomic particle 0
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                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
                                      monocarboxylic acid 0
                                        fatty acid 0
                                          saturated fatty acid 0
                                            branched-chain saturated fatty acid 0
                                              2-methylvaleric acid 0
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