<?xml version="1.0"?>
<?xml-stylesheet type="text/xsl" href="https://ontobee.org/ontology/view/ECTO?iri=http://purl.obolibrary.org/obo/CHEBI_2904"?>
<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://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_23981 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_23981">
        <rdfs:label>ethanolamines</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_2904 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_2904">
        <rdfs:label>atenolol</rdfs:label>
        <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_23981"/>
        <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_29347"/>
        <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_35533"/>
        <rdfs:subClassOf>
            <Restriction>
                <onProperty rdf:resource="http://purl.obolibrary.org/obo/RO_0000087"/>
                <someValuesFrom rdf:resource="http://purl.obolibrary.org/obo/CHEBI_38070"/>
            </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_78298"/>
            </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_35674"/>
            </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_35530"/>
            </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_35703"/>
            </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_66991"/>
            </Restriction>
        </rdfs:subClassOf>
        <oboInOwl:hasDbXref>LINCS:LSM-4355</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>Beilstein:2739235</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>2-(p-(2-Hydroxy-3-(isopropylamino)propoxy)phenyl)acetamide</oboInOwl:hasRelatedSynonym>
        <oboInOwl:id>CHEBI:2904</oboInOwl:id>
        <ns5:inchi>InChI=1S/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18)</ns5:inchi>
        <oboInOwl:hasRelatedSynonym>4-(2-Hydroxy-3-((1-methylethyl)amino)propoxy)benzeneacetamide</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>Patent:DE2007751</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>Wikipedia:Atenolol</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>Patent:US3836671</oboInOwl:hasDbXref>
        <ns5:charge>0</ns5:charge>
        <ns5:formula>C14H22N2O3</ns5:formula>
        <oboInOwl:hasDbXref>Drug_Central:255</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:9813739</oboInOwl:hasDbXref>
        <ns5:smiles>CC(C)NCC(O)COc1ccc(CC(N)=O)cc1</ns5:smiles>
        <oboInOwl:hasDbXref>DrugBank:DB00335</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>HMDB:HMDB0001924</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>atenololum</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>VSDB:2965</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>atenolol</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>KEGG:D00235</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>CAS:29122-68-7</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:23581644</oboInOwl:hasDbXref>
        <ns5:inchikey>METKIMKYRPQLGS-UHFFFAOYSA-N</ns5:inchikey>
        <oboInOwl:hasExactSynonym>2-(4-{2-hydroxy-3-[(propan-2-yl)amino]propoxy}phenyl)acetamide</oboInOwl:hasExactSynonym>
        <oboInOwl:hasDbXref>Reaxys:2739235</oboInOwl:hasDbXref>
        <ns5:monoisotopicmass>266.16304</ns5:monoisotopicmass>
        <oboInOwl:hasRelatedSynonym>1-p-Carbamoylmethylphenoxy-3-isopropylamino-2-propanol</oboInOwl:hasRelatedSynonym>
        <ns4:IAO_0000115>An ethanolamine compound having a (4-carbamoylmethylphenoxy)methyl group at the 1-position and an N-isopropyl substituent.</ns4:IAO_0000115>
        <oboInOwl:hasDbXref>Patent:US3663607</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>Gmelin:2179742</oboInOwl:hasDbXref>
        <oboInOwl:hasOBONamespace>chebi_ontology</oboInOwl:hasOBONamespace>
        <ns5:mass>266.33610</ns5:mass>
        <oboInOwl:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi#3_STAR"/>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_29347 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_29347">
        <rdfs:label>monocarboxylic acid amide</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_35530 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_35530">
        <rdfs:label>beta-adrenergic antagonist</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_35533 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_35533">
        <rdfs:label>propanolamine</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_35674 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_35674">
        <rdfs:label>antihypertensive agent</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_35703 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_35703">
        <rdfs:label>xenobiotic</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_38070 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_38070">
        <rdfs:label>anti-arrhythmia drug</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_66991 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_66991">
        <rdfs:label>sympatholytic agent</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_78298 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_78298">
        <rdfs:label>environmental contaminant</rdfs:label>
    </Class>
</rdf:RDF>



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



