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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:1-(2-naphthalenyl)hexane-1,4-dione
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Accession:CHEBI:114672 term browser browse the term
Definition:A butanone that has formula C16H16O2.
Synonyms:related_synonym: Formula=C16H16O2;   InChI=1S/C16H16O2/c1-2-15(17)9-10-16(18)14-8-7-12-5-3-4-6-13(12)11-14/h3-8,11H,2,9-10H2,1H3;   InChIKey=HVJXZZHMSDQQCF-UHFFFAOYSA-N;   SMILES=CCC(=O)CCC(=O)C1=CC2=CC=CC=C2C=C1
 xref: LINCS:LSM-26134


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  CHEBI ontology 0
    chemical entity 0
      group 0
        inorganic group 0
          oxo group 0
            organic oxo compound 0
              carbonyl compound 0
                ketone 0
                  butanone 0
                    1-(2-naphthalenyl)hexane-1,4-dione 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
                                  carbonyl compound 0
                                    ketone 0
                                      butanone 0
                                        1-(2-naphthalenyl)hexane-1,4-dione 0
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