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    <!-- http://purl.obolibrary.org/obo/CHEBI_25646 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_25646">
        <rdfs:label>octanoate</rdfs:label>
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    <!-- http://purl.obolibrary.org/obo/CHEBI_28837 -->

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        <rdfs:label>octanoic acid</rdfs:label>
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        <oboInOwl:hasDbXref>Beilstein:1747180</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>n-octylic acid</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>1-heptanecarboxylic acid</oboInOwl:hasRelatedSynonym>
        <ns5:charge>0</ns5:charge>
        <oboInOwl:hasDbXref>Wikipedia:Caprylic_acid</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>Drug_Central:3998</oboInOwl:hasDbXref>
        <ns4:IAO_0000115>A straight-chain saturated fatty acid that is heptane in which one of the hydrogens of a terminal methyl group has been replaced by a carboxy group. Octanoic acid is also known as caprylic acid.</ns4:IAO_0000115>
        <oboInOwl:hasExactSynonym>octanoic acid</oboInOwl:hasExactSynonym>
        <oboInOwl:hasExactSynonym>Octanoic acid</oboInOwl:hasExactSynonym>
        <oboInOwl:hasDbXref>PDBeChem:OCA</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>OCTANOIC ACID (CAPRYLIC ACID)</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>octanoic acid</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>Caprylic acid</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>DrugBank:DB04519</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>KEGG:D05220</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>CAS:124-07-2</oboInOwl:hasDbXref>
        <oboInOwl:hasAlternativeId>CHEBI:25648</oboInOwl:hasAlternativeId>
        <oboInOwl:id>CHEBI:28837</oboInOwl:id>
        <oboInOwl:hasRelatedSynonym>Octansaeure</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>Acidum octanocium</oboInOwl:hasRelatedSynonym>
        <ns5:mass>144.21140</ns5:mass>
        <oboInOwl:hasRelatedSynonym>Acide octanoique</oboInOwl:hasRelatedSynonym>
        <ns5:formula>C8H16O2</ns5:formula>
        <oboInOwl:hasDbXref>PMID:16162522</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>C8:0</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>MetaCyc:CPD-195</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>Acido octanoico</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasAlternativeId>CHEBI:3373</oboInOwl:hasAlternativeId>
        <oboInOwl:hasDbXref>PMID:16872526</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>acido octanoico</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>acide octanoique</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>CH3-[CH2]6-COOH</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>octoic acid</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>acidum octanoicum</oboInOwl:hasRelatedSynonym>
        <ns5:smiles>CCCCCCCC(O)=O</ns5:smiles>
        <oboInOwl:hasDbXref>KNApSAcK:C00001231</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>KEGG:C06423</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>n-octanoic acid</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>PMID:19096058</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>Gmelin:142966</oboInOwl:hasDbXref>
        <ns5:monoisotopicmass>144.11503</ns5:monoisotopicmass>
        <ns5:inchi>InChI=1S/C8H16O2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H,9,10)</ns5:inchi>
        <ns5:inchikey>WWZKQHOCKIZLMA-UHFFFAOYSA-N</ns5:inchikey>
        <oboInOwl:hasAlternativeId>CHEBI:44501</oboInOwl:hasAlternativeId>
        <oboInOwl:hasRelatedSynonym>Kaprylsaeure</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>Octylic acid</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>HMDB:HMDB0000482</oboInOwl:hasDbXref>
        <oboInOwl:hasOBONamespace>chebi_ontology</oboInOwl:hasOBONamespace>
        <oboInOwl:hasRelatedSynonym>n-caprylic acid</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>Reaxys:1747180</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>8:0</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>n-octoic acid</oboInOwl:hasRelatedSynonym>
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    <!-- http://purl.obolibrary.org/obo/CHEBI_33282 -->

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        <rdfs:label>antibacterial agent</rdfs:label>
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    <!-- http://purl.obolibrary.org/obo/CHEBI_39418 -->

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        <rdfs:label>straight-chain saturated fatty acid</rdfs:label>
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    <!-- http://purl.obolibrary.org/obo/CHEBI_59554 -->

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        <rdfs:label>medium-chain fatty acid</rdfs:label>
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    <!-- http://purl.obolibrary.org/obo/CHEBI_76971 -->

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        <rdfs:label>Escherichia coli metabolite</rdfs:label>
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    <!-- http://purl.obolibrary.org/obo/CHEBI_77746 -->

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        <rdfs:label>human metabolite</rdfs:label>
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