<?xml version="1.0"?>
<?xml-stylesheet type="text/xsl" href="https://ontobee.org/ontology/view/CDNO?iri=http://purl.obolibrary.org/obo/CHEBI_31336"?>
<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_31336 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_31336">
        <rdfs:label>calcium glycerophosphate</rdfs:label>
        <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_51031"/>
        <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">209.96062</ns4:monoisotopic_mass>
        <ns4:mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">210.135</ns4:mass>
        <oboInOwl:hasRelatedSynonym>Calcium beta-glycerophosphate</oboInOwl:hasRelatedSynonym>
        <ns4:inchi_string>InChI=1S/C3H9O6P.Ca/c4-1-3(2-5)9-10(6,7)8;/h3-5H,1-2H2,(H2,6,7,8);/q;+2/p-2</ns4:inchi_string>
        <oboInOwl:hasOBONamespace>chebi_ontology</oboInOwl:hasOBONamespace>
        <oboInOwl:hasRelatedSynonym>Calcium Glycerophosphate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>kegg.compound:C12935</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>calcium beta-glycerophosphate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasExactSynonym>calcium 1,3-dihydroxypropan-2-yl phosphate</oboInOwl:hasExactSynonym>
        <oboInOwl:id>CHEBI:31336</oboInOwl:id>
        <oboInOwl:hasDbXref>cas:27214-00-2</oboInOwl:hasDbXref>
        <ns4:inchi_key_string>UHHRFSOMMCWGSO-UHFFFAOYSA-L</ns4:inchi_key_string>
        <oboInOwl:hasRelatedSynonym>1,2,3-Propanetriol, mono(dihydrogen phosphate), calcium salt</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>kegg.drug:D01488</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>1,2,3-Propanetriol, mono(dihydrogen phosphate) calcium salt</oboInOwl:hasRelatedSynonym>
        <ns4:smiles_string>O=P([O-])([O-])OC(CO)CO.[Ca+2]</ns4:smiles_string>
        <oboInOwl:hasDbXref>reaxys:3744916</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>beta-glycerophosphoric acid calcium salt</oboInOwl:hasRelatedSynonym>
        <ns3:IAO_0000115>An organic calcium salt having glycerol 2-phosphate(2−) as the counterion.</ns3:IAO_0000115>
        <ns4:generalized_empirical_formula>C3H7O6P.Ca</ns4:generalized_empirical_formula>
        <oboInOwl:hasRelatedSynonym>calcium 1,3-dihydroxypropan-2-yl phosphate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi/3_STAR"/>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_51031 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_51031">
        <rdfs:label>organic calcium salt</rdfs:label>
    </Class>
</rdf:RDF>



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



