<?xml version="1.0"?>
<?xml-stylesheet type="text/xsl" href="https://ontobee.org/ontology/view/CDNO?iri=http://purl.obolibrary.org/obo/CHEBI_28586"?>
<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/wurcs_representation"/>
    <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#hasAlternativeId"/>
    <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_28586 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_28586">
        <rdfs:label>verbascose</rdfs:label>
        <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_74961"/>
        <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">828.27468</ns4:monoisotopic_mass>
        <ns4:mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">828.72</ns4:mass>
        <ns3:IAO_0000115>A pentasaccharide that is stachiose which has an additional unit of α-&lt;small&gt;D&lt;/small&gt;-galactopyranose attached by a 1→6 glycosidic linkage to the terminal galactosyl residue.</ns3:IAO_0000115>
        <oboInOwl:id>CHEBI:28586</oboInOwl:id>
        <ns4:inchi_key_string>FLUADVWHMHPUCG-SWPIJASHSA-N</ns4:inchi_key_string>
        <ns4:smiles_string>OC[C@H]1O[C@H](OC[C@H]2O[C@H](OC[C@H]3O[C@H](OC[C@H]4O[C@H](O[C@]5(CO)O[C@H](CO)[C@@H](O)[C@@H]5O)[C@H](O)[C@@H](O)[C@@H]4O)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O</ns4:smiles_string>
        <oboInOwl:hasRelatedSynonym>D-verbascose</oboInOwl:hasRelatedSynonym>
        <ns4:wurcs_representation>WURCS=2.0/3,5,4/[a2122h-1a_1-5][ha122h-2b_2-5][a2112h-1a_1-5]/1-2-3-3-3/a1-b2_a6-c1_c6-d1_d6-e1</ns4:wurcs_representation>
        <oboInOwl:hasDbXref>pubmed:11675396</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>metacyc.compound:CPD-8065</oboInOwl:hasDbXref>
        <ns4:generalized_empirical_formula>C30H52O26</ns4:generalized_empirical_formula>
        <oboInOwl:hasRelatedSynonym>beta-D-fructofuranosyl alpha-D-galactopyranosyl-(1-&gt;6)-alpha-D-galactopyranosyl-(1-&gt;6)-alpha-D-galactopyranosyl-(1-&gt;6)-alpha-D-glucopyranoside</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>reaxys:77323</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>kegg.compound:C08252</oboInOwl:hasDbXref>
        <oboInOwl:hasAlternativeId>CHEBI:10371</oboInOwl:hasAlternativeId>
        <oboInOwl:hasRelatedSynonym>beta-D-Galp-(1-&gt;6)-beta-D-Galp-(1-&gt;6)-beta-D-Galp-(1-&gt;6)-alpha-D-Glcp-(1&lt;-&gt;2)-beta-D-Fruf</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>kegg.glycan:G00564</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>pubmed:22608234</oboInOwl:hasDbXref>
        <ns4:inchi_string>InChI=1S/C30H52O26/c31-1-7-12(34)17(39)21(43)26(51-7)48-3-9-13(35)18(40)22(44)27(52-9)49-4-10-14(36)19(41)23(45)28(53-10)50-5-11-15(37)20(42)24(46)29(54-11)56-30(6-33)25(47)16(38)8(2-32)55-30/h7-29,31-47H,1-6H2/t7-,8-,9-,10-,11-,12+,13+,14+,15-,16-,17+,18+,19+,20+,21-,22-,23-,24-,25+,26+,27+,28+,29-,30+/m1/s1</ns4:inchi_string>
        <oboInOwl:hasDbXref>knapsack:C00001154</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>cas:546-62-3</oboInOwl:hasDbXref>
        <oboInOwl:hasExactSynonym>beta-D-fructofuranosyl alpha-D-galactopyranosyl-(1-&gt;6)-alpha-D-galactopyranosyl-(1-&gt;6)-alpha-D-galactopyranosyl-(1-&gt;6)-alpha-D-glucopyranoside</oboInOwl:hasExactSynonym>
        <oboInOwl:hasOBONamespace>chebi_ontology</oboInOwl:hasOBONamespace>
        <oboInOwl:hasRelatedSynonym>beta-D-Fructofuranosyl O-alpha-D-galactopyranosyl-(1-6)-O-alpha-D-galactopyranosyl-(1-6)-O-alpha-D-galactopyranosyl-(1-6)-alpha-D-glucopyranoside</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasAlternativeId>CHEBI:22764</oboInOwl:hasAlternativeId>
        <oboInOwl:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi/3_STAR"/>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_74961 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_74961">
        <rdfs:label>raffinose family oligosaccharide</rdfs:label>
    </Class>
</rdf:RDF>



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



