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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:allyl octadecyl oxalate
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Accession:CHEBI:84271 term browser browse the term
Definition:A diester obtained by the formal condensation of both the carboxy group of oxalic acid with the hydroxy groups of allyl alcohol and stearyl alcohol respectively. Metabolite observed in cancer metabolism.
Synonyms:exact_synonym: octadecyl prop-2-en-1-yl ethanedioate
 related_synonym: Formula=C23H42O4;   InChI=1S/C23H42O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-27-23(25)22(24)26-20-4-2/h4H,2-3,5-21H2,1H3;   InChIKey=JUETYCJINGVUAJ-UHFFFAOYSA-N;   SMILES=CCCCCCCCCCCCCCCCCCOC(=O)C(=O)OCC=C
 xref: PMID:25518943



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Path 1
Term Annotations click to browse term
  CHEBI ontology 19860
    role 19832
      application 19675
        pesticide 18041
          fungicide 13961
            allyl alcohol 35
              allyl octadecyl oxalate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19860
    subatomic particle 19858
      composite particle 19858
        hadron 19858
          baryon 19858
            nucleon 19858
              atomic nucleus 19858
                atom 19858
                  main group element atom 19804
                    p-block element atom 19804
                      carbon group element atom 19745
                        carbon atom 19741
                          organic molecular entity 19741
                            heteroorganic entity 19494
                              organochalcogen compound 19257
                                organooxygen compound 19173
                                  carbon oxoacid 18641
                                    carboxylic acid 18638
                                      monocarboxylic acid 18012
                                        fatty acid 16843
                                          fatty acid derivative 8981
                                            fatty alcohol 6130
                                              long-chain fatty alcohol 35
                                                fatty alcohol 18:0 21
                                                  octadecanol 21
                                                    octadecan-1-ol 21
                                                      allyl octadecyl oxalate 0
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