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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-hexenyl isovalerate
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Accession:CHEBI:194237 term browser browse the term
Definition:A fatty acid ester resulting from the formal condensation of the carboxy group of isovaleric acid with the hydroxy group of hex-3-en-1-ol.
Synonyms:exact_synonym: hex-3-en-1-yl 3-methylbutanoate
 related_synonym: 3-hexen-1-yl 3-methylbutanoate;   3-hexen-1-yl isovalerate;   3-hexenyl-3-methylbutanoate;   3-methylbutanoic acid 3-hexen-1-yl ester;   3-methylbutanoic acid 3-hexenyl ester;   FEMA 3498;   Formula=C11H20O2;   InChI=1S/C11H20O2/c1-4-5-6-7-8-13-11(12)9-10(2)3/h5-6,10H,4,7-9H2,1-3H3;   InChIKey=AIQLNKITFBJPFO-UHFFFAOYSA-N;   SMILES=[H]C(CC)=C([H])CCOC(=O)CC(C)C;   hex-3-enyl 3-methylbutyrate;   hex-3-enyl isovalerate;   isovaleric acid 3-hexenyl ester
 xref: AGR:IND607227220;   CAS:10032-11-8;   Chemspider:34011;   PMID:19067110;   PMID:23982679;   Reaxys:30173968


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19890
    role 19839
      application 19703
        food additive 16828
          flavouring agent 4865
            3-hexenyl isovalerate 0
              cis-3-hexenyl isovalerate 0
              trans-3-hexenyl isovalerate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19890
    subatomic particle 19867
      composite particle 19888
        hadron 19888
          baryon 19888
            nucleon 19867
              atomic nucleus 19888
                atom 19888
                  main group element atom 19806
                    p-block element atom 19806
                      carbon group element atom 19746
                        carbon atom 19743
                          organic molecular entity 19743
                            heteroorganic entity 19502
                              organochalcogen compound 19264
                                organooxygen compound 19180
                                  carbon oxoacid 18666
                                    carboxylic acid 18663
                                      monocarboxylic acid 18013
                                        fatty acid 16829
                                          short-chain fatty acid 15922
                                            fatty acid 4:0 8226
                                              butyric acid 6737
                                                methylbutyric acid 2487
                                                  isovaleric acid 1716
                                                    3-hexenyl isovalerate 0
                                                      cis-3-hexenyl isovalerate 0
                                                      trans-3-hexenyl isovalerate 0
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