<?xml version="1.0"?>
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    <!-- http://purl.obolibrary.org/obo/CHEBI_24279 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_24279">
        <rdfs:label>glucosinolate</rdfs:label>
    </Class>
    


    <!-- http://purl.obolibrary.org/obo/CHEBI_5412 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_5412">
        <rdfs:label>gluconapoleiferin(1-)</rdfs:label>
        <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_24279"/>
        <ns4:charge rdf:datatype="http://www.w3.org/2001/XMLSchema#integer">-1</ns4:charge>
        <ns4:monoisotopic_mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">402.05341</ns4:monoisotopic_mass>
        <ns4:mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">402.423</ns4:mass>
        <oboInOwl:hasDbXref>cas:19764-03-5</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>kegg.compound:C08416</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>2-hydroxypent-4-enylglucosinolate</oboInOwl:hasRelatedSynonym>
        <ns4:inchi_string>InChI=1S/C12H21NO10S2/c1-2-3-6(15)4-8(13-23-25(19,20)21)24-12-11(18)10(17)9(16)7(5-14)22-12/h2,6-7,9-12,14-18H,1,3-5H2,(H,19,20,21)/p-1/t6?,7-,9-,10+,11-,12+/m1/s1</ns4:inchi_string>
        <oboInOwl:hasRelatedSynonym>2-hydroxy-4-pentenylglucosinolate</oboInOwl:hasRelatedSynonym>
        <ns4:smiles_string>C=CCC(O)CC(=NOS(=O)(=O)[O-])S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O</ns4:smiles_string>
        <oboInOwl:hasExactSynonym>1-S-[3-hydroxy-N-(sulfonatooxy)hex-5-enimidoyl]-1-thio-beta-D-glucopyranose</oboInOwl:hasExactSynonym>
        <ns4:inchi_key_string>ZEGLQSKFSKZGRO-IAYUFQOSSA-M</ns4:inchi_key_string>
        <ns4:generalized_empirical_formula>C12H20NO10S2</ns4:generalized_empirical_formula>
        <oboInOwl:hasRelatedSynonym>1-S-[3-hydroxy-N-(sulfonatooxy)hex-5-enimidoyl]-1-thio-beta-D-glucopyranose</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>Gluconapoleiferin</oboInOwl:hasRelatedSynonym>
        <ns3:IAO_0000115>A glucosinolate that is glucobrassicanapin which has been hydroxylated at the 3-position of the hex-5-enimidoyl chain.</ns3:IAO_0000115>
        <oboInOwl:id>CHEBI:5412</oboInOwl:id>
        <oboInOwl:hasOBONamespace>chebi_ontology</oboInOwl:hasOBONamespace>
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