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    <!-- http://purl.obolibrary.org/obo/CHEBI_18123 -->

    <Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_18123">
        <rdfs:label>N-methylnicotinate</rdfs:label>
        <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_24431"/>
        <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">137.04768</ns4:monoisotopic_mass>
        <ns4:mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">137.138</ns4:mass>
        <oboInOwl:hasRelatedSynonym>Trigonelline</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>metacyc.compound:METHYLNICOTINATE</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>N&#39;-Methylnicotinate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>hmdb:HMDB0000875</oboInOwl:hasDbXref>
        <ns4:inchi_string>InChI=1S/C7H7NO2/c1-8-4-2-3-6(5-8)7(9)10/h2-5H,1H3</ns4:inchi_string>
        <oboInOwl:hasDbXref>pubmed:17190852</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>3-Carboxy-1-methylpyridinium hydroxide inner salt</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>Coffearin</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasAlternativeId>CHEBI:19067</oboInOwl:hasAlternativeId>
        <oboInOwl:hasRelatedSynonym>1-methylpyridinium-3-carboxylate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>pubmed:22559314</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>Betain nicotinate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasAlternativeId>CHEBI:12522</oboInOwl:hasAlternativeId>
        <oboInOwl:hasRelatedSynonym>1-Methyl-3-pyridiniumcarboxylate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>pubmed:185134</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>beilstein:3905114</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>pubmed:22393699</oboInOwl:hasDbXref>
        <oboInOwl:hasOBONamespace>chebi_ontology</oboInOwl:hasOBONamespace>
        <oboInOwl:hasRelatedSynonym>Nicotinic acid N-methylbetaine</oboInOwl:hasRelatedSynonym>
        <ns3:IAO_0000115>An iminium betaine that is the conjugate base of &lt;em&gt;N&lt;/em&gt;-methylnicotinic acid, arising from deprotonation of the carboxy group.</ns3:IAO_0000115>
        <oboInOwl:hasAlternativeId>CHEBI:7320</oboInOwl:hasAlternativeId>
        <oboInOwl:hasExactSynonym>1-methylpyridinium-3-carboxylate</oboInOwl:hasExactSynonym>
        <oboInOwl:hasRelatedSynonym>1-Methylpyridinio-3-carboxylate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>Betaine nicotinate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>Caffearine</oboInOwl:hasRelatedSynonym>
        <ns4:generalized_empirical_formula>C7H7NO2</ns4:generalized_empirical_formula>
        <oboInOwl:hasRelatedSynonym>1-methylnicotinate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>N-methylnicotinate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>Trigonellin</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasRelatedSynonym>Gynesine</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>pubmed:22312719</oboInOwl:hasDbXref>
        <ns4:inchi_key_string>WWNNZCOKKKDOPX-UHFFFAOYSA-N</ns4:inchi_key_string>
        <oboInOwl:hasRelatedSynonym>N-methyl-nicotinate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>pubmed:22242555</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>Caffearin</oboInOwl:hasRelatedSynonym>
        <oboInOwl:id>CHEBI:18123</oboInOwl:id>
        <oboInOwl:hasDbXref>pubmed:24047691</oboInOwl:hasDbXref>
        <ns4:smiles_string>C[n+]1cccc(C(=O)[O-])c1</ns4:smiles_string>
        <oboInOwl:hasRelatedSynonym>N-Methylnicotinate</oboInOwl:hasRelatedSynonym>
        <oboInOwl:hasDbXref>knapsack:C00001555</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>kegg.compound:C01004</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>reaxys:3905114</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>pubmed:13128691</oboInOwl:hasDbXref>
        <oboInOwl:hasDbXref>cas:535-83-1</oboInOwl:hasDbXref>
        <oboInOwl:hasRelatedSynonym>Trigenelline</oboInOwl:hasRelatedSynonym>
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