<?xml version="1.0"?>
<?xml-stylesheet type="text/xsl" href="https://ontobee.org/ontology/view/CDNO?iri=http://purl.obolibrary.org/obo/CHEBI_27266"?>
<rdf:RDF xmlns="http://www.w3.org/2002/07/owl#"
     xml:base="http://www.w3.org/2002/07/owl"
     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="https://w3id.org/chemrof/"
     xmlns:foaf="http://xmlns.com/foaf/0.1/"
     xmlns:dc="http://purl.org/dc/elements/1.1/"
     xmlns:ns3="http://purl.obolibrary.org/obo/">
    


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

    <AnnotationProperty rdf:about="https://w3id.org/chemrof/inchi_key_string"/>
    <AnnotationProperty rdf:about="https://w3id.org/chemrof/smiles_string"/>
    <AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/IAO_0000115"/>
    <AnnotationProperty rdf:about="https://w3id.org/chemrof/charge"/>
    <AnnotationProperty rdf:about="http://www.geneontology.org/formats/oboInOwl#hasDbXref"/>
    <AnnotationProperty rdf:about="http://www.geneontology.org/formats/oboInOwl#hasRelatedSynonym"/>
    <AnnotationProperty rdf:about="http://www.geneontology.org/formats/oboInOwl#id"/>
    <AnnotationProperty rdf:about="https://w3id.org/chemrof/generalized_empirical_formula"/>
    <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/3_STAR"/>
    <AnnotationProperty rdf:about="http://www.geneontology.org/formats/oboInOwl#inSubset"/>
    <AnnotationProperty rdf:about="https://w3id.org/chemrof/mass"/>
    <AnnotationProperty rdf:about="https://w3id.org/chemrof/inchi_string"/>
    <AnnotationProperty rdf:about="https://w3id.org/chemrof/monoisotopic_mass"/>
    


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

    


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

    


    <!-- http://purl.obolibrary.org/obo/CHEBI_27266 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_27266">
        <rdfs:label>valine</rdfs:label>
        <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_33709"/>
        <ns4:charge rdf:datatype="http://www.w3.org/2001/XMLSchema#integer">0</ns4:charge>
        <ns4:monoisotopic_mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">117.07898</ns4:monoisotopic_mass>
        <ns4:mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">117.148</ns4:mass>
        <oboInOwl:hasRelatedSynonym>valina</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>pubmed:17190852</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>Hval</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>valine</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>gmelin:49877</oboInOwl:hasDbXref>
        <ns4:inchi_string>InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)</ns4:inchi_string>
        <ns3:IAO_0000115>A branched-chain amino acid that consists of glycine in which one of the hydrogens attached to the α-carbon is substituted by an isopropyl group.</ns3:IAO_0000115>
        <oboInOwl:hasDbXref>cas:516-06-3</oboInOwl:hasDbXref>
        <ns4:generalized_empirical_formula>C5H11NO2</ns4:generalized_empirical_formula>
        <oboInOwl:id>CHEBI:27266</oboInOwl:id>
        <oboInOwl:hasDbXref>pubmed:22770225</oboInOwl:hasDbXref>
        <oboInOwl:hasExactSynonym>valine</oboInOwl:hasExactSynonym>
        <ns4:inchi_key_string>KZSNJWFQEVHDMF-UHFFFAOYSA-N</ns4:inchi_key_string>
        <oboInOwl:hasRelatedSynonym>Valin</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>kegg.compound:C16436</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>wikipedia.en:Valine</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>2-amino-3-methylbutanoic acid</oboInOwl:hasRelatedSynonym>
        <ns4:smiles_string>CC(C)C(N)C(=O)O</ns4:smiles_string>
        <oboInOwl:hasRelatedSynonym>DL-valine</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>reaxys:506689</oboInOwl:hasDbXref>
        <oboInOwl:hasOBONamespace>chebi_ontology</oboInOwl:hasOBONamespace>
        <oboInOwl:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi/3_STAR"/>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_33709 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_33709">
        <rdfs:label>amino acid</rdfs:label>
    </Class>
</rdf:RDF>



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



