<?xml version="1.0"?>
<?xml-stylesheet type="text/xsl" href="https://ontobee.org/ontology/view/ECTO?iri=http://purl.obolibrary.org/obo/CHEBI_18385"?>
<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:chebi2="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
    //
    ///////////////////////////////////////////////////////////////////////////////////////
     -->

    


    <!-- http://www.w3.org/XML/1998/namespacestring -->

    <rdfs:Datatype rdf:about="http://www.w3.org/XML/1998/namespacestring"/>
    


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


    <!-- http://purl.obolibrary.org/obo/chebi#is_conjugate_base_of -->

    <ObjectProperty rdf:about="http://purl.obolibrary.org/obo/chebi#is_conjugate_base_of"/>
    


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

    


    <!-- http://purl.obolibrary.org/obo/CHEBI_15734 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_15734">
        <rdfs:label>primary alcohol</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_18385 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_18385">
        <rdfs:label>thiamine(1+)</rdfs:label>
        <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_15734"/>
        <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_26948"/>
        <rdfs:subClassOf>
            <Restriction>
                <onProperty rdf:resource="http://purl.obolibrary.org/obo/RO_0000087"/>
                <someValuesFrom rdf:resource="http://purl.obolibrary.org/obo/CHEBI_75772"/>
            </Restriction>
        </rdfs:subClassOf>
        <rdfs:subClassOf>
            <Restriction>
                <onProperty rdf:resource="http://purl.obolibrary.org/obo/chebi#is_conjugate_base_of"/>
                <someValuesFrom rdf:resource="http://purl.obolibrary.org/obo/CHEBI_49107"/>
            </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_75771"/>
            </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_77746"/>
            </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_76971"/>
            </Restriction>
        </rdfs:subClassOf>
        <ns5:monoisotopicmass>265.11176</ns5:monoisotopicmass>
        <oboInOwl:hasDbXref>LINCS:LSM-5996</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>3-(4-AMINO-2-METHYL-PYRIMIDIN-5-YLMETHYL)-5-(2-HYDROXY-ETHYL)-4-METHYL-THIAZOL-3-IUM</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>PMID:8619543</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:18652651</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:8192530</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>Thiamin</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>DrugBank:DB00152</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:15862682</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>Chemspider:1098</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>KEGG:C00378</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:21706007</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:7291135</oboInOwl:hasDbXref>
        <ns5:mass>265.350</ns5:mass>
        <ns5:smiles>CC1=C(CCO)SC=[N+]1CC1=CN=C(C)N=C1N</ns5:smiles>
        <oboInOwl:hasAlternativeId>CHEBI:26941</oboInOwl:hasAlternativeId>
        <oboInOwl:hasDbXref>PMID:21848803</oboInOwl:hasDbXref>
        <ns4:IAO_0000115>A primary alcohol that is 1,3-thiazol-3-ium substituted by (4-amino-2-methylpyrimidin-5-yl)methyl, methyl and 2-hydroxyethyl groups at positions 3, 4 and 5, respectively.</ns4:IAO_0000115>
        <oboInOwl:hasDbXref>PMID:15451668</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:12111441</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:7731897</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:16645728</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:9387133</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>thiamine(1+) ion</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>PMID:10436256</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:10542220</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>thiamine</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>CAS:70-16-6</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>Antiberiberi factor</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>PMID:11899071</oboInOwl:hasDbXref>
        <oboInOwl:hasExactSynonym>3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium</oboInOwl:hasExactSynonym>
        <oboInOwl:hasDbXref>PDBeChem:VIB</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:11977806</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>thiaminium</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>KNApSAcK:C00000775</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:11015250</oboInOwl:hasDbXref>
        <ns5:inchikey>JZRWCGZRTZMZEH-UHFFFAOYSA-N</ns5:inchikey>
        <oboInOwl:hasDbXref>Beilstein:3595616</oboInOwl:hasDbXref>
        <oboInOwl:hasAlternativeId>CHEBI:15227</oboInOwl:hasAlternativeId>
        <oboInOwl:hasDbXref>PMID:7733128</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>Drug_Central:2832</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:1538220</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>thiamine cation</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>PMID:17964830</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>PMID:10883001</oboInOwl:hasDbXref>
        <oboInOwl:hasAlternativeId>CHEBI:46393</oboInOwl:hasAlternativeId>
        <oboInOwl:id>CHEBI:18385</oboInOwl:id>
        <oboInOwl:hasRelatedSynonym>thiamine ion</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>vitamin B1</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>PMID:24768306</oboInOwl:hasDbXref>
        <ns5:charge>+1</ns5:charge>
        <oboInOwl:hasDbXref>PMID:8205249</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>MetaCyc:THIAMINE</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>Wikipedia:Thiamine</oboInOwl:hasDbXref>
        <oboInOwl:hasOBONamespace>chebi_ontology</oboInOwl:hasOBONamespace>
        <oboInOwl:hasRelatedSynonym>Vitamin B1</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>PMID:24079939</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>Gmelin:334462</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>HMDB:HMDB0000235</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>Thiamine</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>Aneurin</oboInOwl:hasRelatedSynonym>
        <ns5:inchi>InChI=1S/C12H17N4OS/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15)/q+1</ns5:inchi>
        <oboInOwl:hasDbXref>PMID:8522961</oboInOwl:hasDbXref>
        <oboInOwl:hasAlternativeId>CHEBI:9530</oboInOwl:hasAlternativeId>
        <oboInOwl:hasDbXref>FooDB:FDB008424</oboInOwl:hasDbXref>
        <ns5:formula>C12H17N4OS</ns5:formula>
        <oboInOwl:hasDbXref>PMID:11435118</oboInOwl:hasDbXref>
        <oboInOwl:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi#3_STAR"/>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_26948 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_26948">
        <rdfs:label rdf:datatype="http://www.w3.org/XML/1998/namespacestring">vitamin B1</rdfs:label>
        <rdfs:label>vitamin B1</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_49107 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_49107">
        <rdfs:label>thiamine(2+)</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_75771 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_75771">
        <rdfs:label>mouse metabolite</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_75772 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_75772">
        <rdfs:label>Saccharomyces cerevisiae metabolite</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_76971 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_76971">
        <rdfs:label>Escherichia coli metabolite</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_77746 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_77746">
        <rdfs:label>human metabolite</rdfs:label>
    </Class>
</rdf:RDF>



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



