<?xml version="1.0"?>
<?xml-stylesheet type="text/xsl" href="https://ontobee.org/ontology/view/MICRO?iri=http://purl.obolibrary.org/obo/CHEBI_77509"?>
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     xml:base="http://www.w3.org/2002/07/owl"
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     xmlns:oboInOwl="http://www.geneontology.org/formats/oboInOwl#"
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     xmlns:dc="http://purl.org/dc/elements/1.1/">
    


    <!-- 
    ///////////////////////////////////////////////////////////////////////////////////////
    //
    // Annotation properties
    //
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    <AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/IAO_0000412"/>
    <AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/IAO_0000115"/>
    <AnnotationProperty rdf:about="http://www.geneontology.org/formats/oboInOwl#hasDbXref"/>
    <AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/chebi/inchi"/>
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    <AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/chebi/smiles"/>
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    <AnnotationProperty rdf:about="http://www.geneontology.org/formats/oboInOwl#hasExactSynonym"/>
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    <AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/chebi/mass"/>
    


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    <!-- 
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    //
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    <!-- http://purl.obolibrary.org/obo/CHEBI_18310 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_18310">
        <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">alkane</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_77509 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_77509">
        <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">2,2,4,6,6-pentamethylheptane</rdfs:label>
        <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_18310"/>
        <ns4:monoisotopicmass rdf:datatype="http://www.w3.org/2001/XMLSchema#string">170.203</ns4:monoisotopicmass>
        <ns4:mass rdf:datatype="http://www.w3.org/2001/XMLSchema#string">170.33480</ns4:mass>
        <oboInOwl:hasExactSynonym rdf:datatype="http://www.w3.org/2001/XMLSchema#string">2,2,4,6,6-pentamethylheptane</oboInOwl:hasExactSynonym>
        <ns2:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A branched alkane that is heptane carrying two methyl groups each at positions 2 and 6, and one methyl group at position 4.</ns2:IAO_0000115>
        <ns4:formula rdf:datatype="http://www.w3.org/2001/XMLSchema#string">C12H26</ns4:formula>
        <oboInOwl:hasDbXref rdf:datatype="http://www.w3.org/2001/XMLSchema#string">CAS:13475-82-6</oboInOwl:hasDbXref>
        <ns4:smiles rdf:datatype="http://www.w3.org/2001/XMLSchema#string">CC(CC(C)(C)C)CC(C)(C)C</ns4:smiles>
        <oboInOwl:id rdf:datatype="http://www.w3.org/2001/XMLSchema#string">CHEBI:77509</oboInOwl:id>
        <ns4:inchi rdf:datatype="http://www.w3.org/2001/XMLSchema#string">InChI=1S/C12H26/c1-10(8-11(2,3)4)9-12(5,6)7/h10H,8-9H2,1-7H3</ns4:inchi>
        <oboInOwl:hasDbXref rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Reaxys:1731750</oboInOwl:hasDbXref>
        <ns4:inchikey rdf:datatype="http://www.w3.org/2001/XMLSchema#string">VKPSKYDESGTTFR-UHFFFAOYSA-N</ns4:inchikey>
        <oboInOwl:hasOBONamespace rdf:datatype="http://www.w3.org/2001/XMLSchema#string">chebi_ontology</oboInOwl:hasOBONamespace>
        <oboInOwl:inSubset rdf:resource="http://purl.oboInOwllibrary.org/oboInOwl/chebi#3_STAR"/>
        <ns2:IAO_0000412 rdf:resource="http://purl.obolibrary.org/obo/chebi.owl"/>
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<!-- Generated by the OWL API (version 3.2.4.1806) http://owlapi.sourceforge.net -->



