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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 butyryllactate
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Accession:CHEBI:168668 term browser browse the term
Definition:A diester resulting from the formal condensation of the carboxy group of 2-(butanoyloxy)propanoic acid with butan-1-ol.
Synonyms:related_synonym: (1-butoxy-1-oxopropan-2-yl) butanoate;   1-butoxy-1-oxopropan-2-yl butyrate;   2-butoxy-1-methyl-2-oxoethyl butanoate;   FEMA 2190;   Formula=C11H20O4;   InChI=1S/C11H20O4/c1-4-6-8-14-11(13)9(3)15-10(12)7-5-2/h9H,4-8H2,1-3H3;   InChIKey=NORZZKKLCYMBBF-UHFFFAOYSA-N;   O-butyryllactic acid butyl ester;   SMILES=CCCCOC(=O)C(C)OC(=O)CCC;   butanoic acid 2-butoxy-1-methyl-2-oxoethyl ester;   butyl 2-(butyryloxy)propionate;   butyl O-butyryllactate;   butyl butyrolactate;   butyl butyryl lactate;   butyric acid ester with butyl lactate;   lactic acid, butyl ester, butyrate;   n-butyl n-butyryl lactate
 xref: CAS:7492-70-8;   Chemspider:22539;   FooDB:FDB016132;   HMDB:HMDB0037137;   LIPID_MAPS_instance:LMFA07010792;   PMID:30402589;   PMID:34452275;   PMID:34471210;   Reaxys:1709603

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Path 1
Term Annotations click to browse term
  CHEBI ontology 0
    role 0
      application 0
        food additive 0
          flavouring agent 0
            butyl butyryllactate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                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
                                          fatty acid derivative 0
                                            fatty alcohol 0
                                              primary fatty alcohol 0
                                                short-chain primary fatty alcohol 0
                                                  butan-1-ol 0
                                                    butyl butyryllactate 0
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