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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:butyl butanoate
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Accession:CHEBI:87429 term browser browse the term
Definition:A butanoate ester of butan-1-ol.
Synonyms:related_synonym: Formula=C8H16O2;   InChI=1S/C8H16O2/c1-3-5-7-10-8(9)6-4-2/h3-7H2,1-2H3;   InChIKey=XUPYJHCZDLZNFP-UHFFFAOYSA-N;   SMILES=CCCCOC(=O)CCC;   n-butyl butanoate;   n-butyl butyrate;   n-butyric n-butyl ester
 xref: CAS:109-21-7;   HMDB:HMDB0039620;   PMID:21892724;   Reaxys:1747101;   Wikipedia:Butyl_butyrate


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Path 1
Term Annotations click to browse term
  CHEBI ontology 22210
    role 22195
      biological role 22194
        biochemical role 21464
          metabolite 21412
            butyl butanoate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 22210
    subatomic particle 22202
      composite particle 22202
        hadron 22202
          baryon 22202
            nucleon 22202
              atomic nucleus 22202
                atom 22202
                  main group element atom 22136
                    p-block element atom 22136
                      carbon group element atom 21936
                        carbon atom 21861
                          organic molecular entity 21861
                            heteroorganic entity 21517
                              organochalcogen compound 21005
                                organooxygen compound 20846
                                  carbon oxoacid 19634
                                    carboxylic acid 19630
                                      monocarboxylic acid 19004
                                        fatty acid 17240
                                          fatty acid derivative 9018
                                            fatty alcohol 6118
                                              primary fatty alcohol 5773
                                                short-chain primary fatty alcohol 5764
                                                  butan-1-ol 5729
                                                    butyl butanoate 0
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