<?xml version="1.0"?>
<?xml-stylesheet type="text/xsl" href="https://ontobee.org/ontology/view/ECTO?iri=http://purl.obolibrary.org/obo/CHEBI_17747"?>
<rdf:RDF xmlns="http://www.w3.org/2002/07/owl#"
     xml:base="http://www.w3.org/2002/07/owl"
     xmlns:ns5="http://purl.obolibrary.org/obo/chebi/"
     xmlns:chebi="http://purl.obolibrary.org/obo/chebi#3"
     xmlns:rdf="http://www.w3.org/1999/02/22-rdf-syntax-ns#"
     xmlns:owl="http://www.w3.org/2002/07/owl#"
     xmlns:oboInOwl="http://www.geneontology.org/formats/oboInOwl#"
     xmlns:xsd="http://www.w3.org/2001/XMLSchema#"
     xmlns:rdfs="http://www.w3.org/2000/01/rdf-schema#"
     xmlns:ns4="http://purl.obolibrary.org/obo/"
     xmlns:foaf="http://xmlns.com/foaf/0.1/"
     xmlns:dc="http://purl.org/dc/elements/1.1/">
    


    <!-- 
    ///////////////////////////////////////////////////////////////////////////////////////
    //
    // Annotation properties
    //
    ///////////////////////////////////////////////////////////////////////////////////////
     -->

    <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"/>
    <AnnotationProperty rdf:about="http://www.geneontology.org/formats/oboInOwl#hasRelatedSynonym"/>
    <AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/chebi#3_STAR"/>
    <AnnotationProperty rdf:about="http://www.geneontology.org/formats/oboInOwl#id"/>
    <AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/chebi/charge"/>
    <AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/chebi/smiles"/>
    <AnnotationProperty rdf:about="http://www.geneontology.org/formats/oboInOwl#hasOBONamespace"/>
    <AnnotationProperty rdf:about="http://www.geneontology.org/formats/oboInOwl#hasExactSynonym"/>
    <AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/chebi/inchikey"/>
    <AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/chebi/monoisotopicmass"/>
    <AnnotationProperty rdf:about="http://www.geneontology.org/formats/oboInOwl#hasAlternativeId"/>
    <AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/chebi/formula"/>
    <AnnotationProperty rdf:about="http://www.geneontology.org/formats/oboInOwl#inSubset"/>
    <AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/chebi/mass"/>
    


    <!-- 
    ///////////////////////////////////////////////////////////////////////////////////////
    //
    // Datatypes
    //
    ///////////////////////////////////////////////////////////////////////////////////////
     -->

    


    <!-- 
    ///////////////////////////////////////////////////////////////////////////////////////
    //
    // Object Properties
    //
    ///////////////////////////////////////////////////////////////////////////////////////
     -->

    


    <!-- http://purl.obolibrary.org/obo/RO_0000087 -->

    <ObjectProperty rdf:about="http://purl.obolibrary.org/obo/RO_0000087">
        <rdfs:label xml:lang="en">has role</rdfs:label>
    </ObjectProperty>
    


    <!-- 
    ///////////////////////////////////////////////////////////////////////////////////////
    //
    // Classes
    //
    ///////////////////////////////////////////////////////////////////////////////////////
     -->

    


    <!-- http://purl.obolibrary.org/obo/CHEBI_17747 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_17747">
        <rdfs:label>bis(2-ethylhexyl) phthalate</rdfs:label>
        <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_35484"/>
        <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_51307"/>
        <rdfs:subClassOf>
            <Restriction>
                <onProperty rdf:resource="http://purl.obolibrary.org/obo/RO_0000087"/>
                <someValuesFrom rdf:resource="http://purl.obolibrary.org/obo/CHEBI_79056"/>
            </Restriction>
        </rdfs:subClassOf>
        <rdfs:subClassOf>
            <Restriction>
                <onProperty rdf:resource="http://purl.obolibrary.org/obo/RO_0000087"/>
                <someValuesFrom rdf:resource="http://purl.obolibrary.org/obo/CHEBI_77326"/>
            </Restriction>
        </rdfs:subClassOf>
        <rdfs:subClassOf>
            <Restriction>
                <onProperty rdf:resource="http://purl.obolibrary.org/obo/RO_0000087"/>
                <someValuesFrom rdf:resource="http://purl.obolibrary.org/obo/CHEBI_68494"/>
            </Restriction>
        </rdfs:subClassOf>
        <oboInOwl:hasRelatedSynonym>Di(ethylhexyl) phthalate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>PMID:19840837</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>Dioctyl phthalate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>PMID:28763719</oboInOwl:hasDbXref>
        <oboInOwl:hasAlternativeId>CHEBI:3116</oboInOwl:hasAlternativeId>
        <oboInOwl:hasRelatedSynonym>Bis(2-ethylhexyl) o-phthalate</oboInOwl:hasRelatedSynonym>
        <ns5:smiles>CCCCC(CC)COC(=O)c1ccccc1C(=O)OCC(CC)CCCC</ns5:smiles>
        <oboInOwl:hasRelatedSynonym>Di(2-ethylhexyl) o-phthalate</oboInOwl:hasRelatedSynonym>
        <ns5:mass>390.55612</ns5:mass>
        <ns5:monoisotopicmass>390.27701</ns5:monoisotopicmass>
        <ns4:IAO_0000115>A phthalate ester that is the bis(2-ethylhexyl) ester of benzene-1,2-dicarboxylic acid.</ns4:IAO_0000115>
        <oboInOwl:hasDbXref>Beilstein:1890696</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>Bis(ethylhexyl) phthalate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>PMID:12963402</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:17286146</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:16874505</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>2-Ethylhexyl phthalate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>Di-sec-octyl phthalate</oboInOwl:hasRelatedSynonym>
        <ns5:inchikey>BJQHLKABXJIVAM-UHFFFAOYSA-N</ns5:inchikey>
        <ns5:inchi>InChI=1S/C24H38O4/c1-5-9-13-19(7-3)17-27-23(25)21-15-11-12-16-22(21)24(26)28-18-20(8-4)14-10-6-2/h11-12,15-16,19-20H,5-10,13-14,17-18H2,1-4H3</ns5:inchi>
        <oboInOwl:hasRelatedSynonym>1,2-Benzenedicarboxylic acid bis(2-ethylhexyl) ester</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>CAS:117-81-7</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:19211671</oboInOwl:hasDbXref>
        <oboInOwl:hasAlternativeId>CHEBI:22889</oboInOwl:hasAlternativeId>
        <oboInOwl:hasOBONamespace>chebi_ontology</oboInOwl:hasOBONamespace>
        <oboInOwl:hasRelatedSynonym>Bis(2-ethylhexyl)phthalate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>PMID:28199414</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>Octyl phthalate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>Diethylhexyl phthalate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>bis(2-ethylhexyl)phthalate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>MetaCyc:BIS2-ETHYLHEXYLPHTHALATE</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>Phthalic acid di(2-ethylhexyl) ester</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>Reaxys:1890696</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>Wikipedia:Bis(2-ethylhexyl)_phthalate</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>di-iso-Octyl phthalate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>Di(2-ethylhexyl)orthophthalate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:id>CHEBI:17747</oboInOwl:id>
        <ns5:formula>C24H38O4</ns5:formula>
        <oboInOwl:hasDbXref>KEGG:C03690</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>DEHP</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasExactSynonym>bis(2-ethylhexyl) benzene-1,2-dicarboxylate</oboInOwl:hasExactSynonym>
        <oboInOwl:hasRelatedSynonym>Phthalic acid bis(2-ethylhexyl) ester</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>Di(2-ethylhexyl)phthalate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasAlternativeId>CHEBI:13911</oboInOwl:hasAlternativeId>
        <ns5:charge>0</ns5:charge>
        <oboInOwl:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi#3_STAR"/>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_35484 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_35484">
        <rdfs:label>phthalate ester</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_51307 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_51307">
        <rdfs:label>diester</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_68494 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_68494">
        <rdfs:label>apoptosis inhibitor</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_77326 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_77326">
        <rdfs:label>androstane receptor agonist</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_79056 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_79056">
        <rdfs:label>plasticiser</rdfs:label>
    </Class>
</rdf:RDF>



<!-- Generated by the OWL API (version 3.2.4.1806) http://owlapi.sourceforge.net -->



