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    <!-- http://purl.obolibrary.org/obo/CHEBI_18044 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_18044">
        <rdfs:label>dialkyl ketone</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_26013 -->

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        <rdfs:label>pheromone</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_51867 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_51867">
        <rdfs:label rdf:datatype="http://www.w3.org/XML/1998/namespacestring">methyl ketone</rdfs:label>
        <rdfs:label>methyl ketone</rdfs:label>
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    <!-- http://purl.obolibrary.org/obo/CHEBI_5672 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_5672">
        <rdfs:label>heptan-2-one</rdfs:label>
        <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_18044"/>
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        <oboInOwl:hasDbXref>KEGG:C08380</oboInOwl:hasDbXref>
        <ns5:mass>114.18546</ns5:mass>
        <oboInOwl:hasRelatedSynonym>2-Heptanone</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>PMID:20416794</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:16025460</oboInOwl:hasDbXref>
        <oboInOwl:hasExactSynonym>heptan-2-one</oboInOwl:hasExactSynonym>
        <oboInOwl:id>CHEBI:5672</oboInOwl:id>
        <oboInOwl:hasDbXref>Beilstein:1699063</oboInOwl:hasDbXref>
        <ns4:IAO_0000115>A dialkyl ketone with methyl and pentyl as the alkyl groups.</ns4:IAO_0000115>
        <oboInOwl:hasDbXref>KNApSAcK:C00001254</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>Wikipedia:2-Heptanone</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:2270874</oboInOwl:hasDbXref>
        <ns5:inchi>InChI=1S/C7H14O/c1-3-4-5-6-7(2)8/h3-6H2,1-2H3</ns5:inchi>
        <ns5:monoisotopicmass>114.10447</ns5:monoisotopicmass>
        <oboInOwl:hasDbXref>CAS:110-43-0</oboInOwl:hasDbXref>
        <ns5:formula>C7H14O</ns5:formula>
        <oboInOwl:hasRelatedSynonym>Methyl n-amyl ketone</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>butylacetone</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasOBONamespace>chebi_ontology</oboInOwl:hasOBONamespace>
        <oboInOwl:hasDbXref>Reaxys:1699063</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:14759148</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>Gmelin:305860</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>n-amyl methyl ketone</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>n-pentyl methyl ketone</oboInOwl:hasRelatedSynonym>
        <ns5:smiles>CCCCCC(C)=O</ns5:smiles>
        <ns5:inchikey>CATSNJVOTSVZJV-UHFFFAOYSA-N</ns5:inchikey>
        <ns5:charge>0</ns5:charge>
        <oboInOwl:hasExactSynonym>Heptan-2-one</oboInOwl:hasExactSynonym>
        <oboInOwl:hasRelatedSynonym>methyl pentyl ketone</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>PMID:12769891</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>LIPID_MAPS_instance:LMFA12000004</oboInOwl:hasDbXref>
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    <!-- http://purl.obolibrary.org/obo/CHEBI_75771 -->

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        <rdfs:label>mouse metabolite</rdfs:label>
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