<?xml version="1.0" encoding="UTF-8"?> <rdf:RDF xmlns:rdf="http://www.w3.org/1999/02/22-rdf-syntax-ns#" xmlns:obo_purl="http://purl.obolibrary.org/obo/" xmlns:owl="http://www.w3.org/2002/07/owl#" xmlns:rdfs="http://www.w3.org/2000/01/rdf-schema#" xmlns:ns0="https://w3id.org/chemrof/" xmlns:skos="http://www.w3.org/2004/02/skos/core#" xmlns:oboinowl_gen="http://www.geneontology.org/formats/oboInOwl#" xmlns:metadata_def="http://data.bioontology.org/metadata/def/"> <owl:Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_73067"> <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_24431"/> <rdfs:label>O-palmitoylcarnitine</rdfs:label> <ns0:charge rdf:datatype="http://www.w3.org/2001/XMLSchema#integer">0</ns0:charge> <ns0:generalized_empirical_formula>C23H45NO4</ns0:generalized_empirical_formula> <ns0:inchi_key_string>XOMRRQXKHMYMOC-UHFFFAOYSA-N</ns0:inchi_key_string> <ns0:inchi_string>InChI=1S/C23H45NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(27)28-21(19-22(25)26)20-24(2,3)4/h21H,5-20H2,1-4H3</ns0:inchi_string> <ns0:mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">399.616</ns0:mass> <ns0:monoisotopic_mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">399.33486</ns0:monoisotopic_mass> <ns0:smiles_string>CCCCCCCCCCCCCCCC(=O)OC(CC(=O)[O-])C[N+](C)(C)C</ns0:smiles_string> <skos:notation>CHEBI:73067</skos:notation> <obo_purl:IAO_0000115>An &lt;em&gt;O&lt;/em&gt;-acylcarnitine having palmitoyl (hexadecanoyl) as the acyl substituent.</obo_purl:IAO_0000115> <oboinowl_gen:hasExactSynonym>3-(hexadecanoyloxy)-4-(trimethylazaniumyl)butanoate</oboinowl_gen:hasExactSynonym> <oboinowl_gen:hasDbXref>cas:1935-18-8</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>pubmed:23315938</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>reaxys:4152032</oboinowl_gen:hasDbXref> <oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace> <oboinowl_gen:id>CHEBI:73067</oboinowl_gen:id> <oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi/3_STAR"/> <metadata_def:prefLabel>O-palmitoylcarnitine</metadata_def:prefLabel> <oboinowl_gen:hasRelatedSynonym>3-(hexadecanoyloxy)-4-(trimethylammonio)butanoate</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>O-hexadecanoylcarnitine</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>hexadecanoylcarnitine</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>hexadecanoylcarnitines</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>palmitoylcarnitine</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>3-(hexadecanoyloxy)-4-(trimethylazaniumyl)butanoate</oboinowl_gen:hasRelatedSynonym> <metadata_def:mappingLoom>opalmitoylcarnitine</metadata_def:mappingLoom> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_73067"/> </owl:Class> <rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_73067"> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_73067"/> </rdf:Description> </rdf:RDF>
<?xml version="1.0" encoding="UTF-8"?>
<rdf:RDF xmlns:rdf="http://www.w3.org/1999/02/22-rdf-syntax-ns#" xmlns:obo_purl="http://purl.obolibrary.org/obo/" xmlns:owl="http://www.w3.org/2002/07/owl#" xmlns:rdfs="http://www.w3.org/2000/01/rdf-schema#" xmlns:ns0="https://w3id.org/chemrof/" xmlns:skos="http://www.w3.org/2004/02/skos/core#" xmlns:oboinowl_gen="http://www.geneontology.org/formats/oboInOwl#" xmlns:metadata_def="http://data.bioontology.org/metadata/def/">
  <owl:Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_73067">
    <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_24431"/>
    <rdfs:label>O-palmitoylcarnitine</rdfs:label>
    <ns0:charge rdf:datatype="http://www.w3.org/2001/XMLSchema#integer">0</ns0:charge>
    <ns0:generalized_empirical_formula>C23H45NO4</ns0:generalized_empirical_formula>
    <ns0:inchi_key_string>XOMRRQXKHMYMOC-UHFFFAOYSA-N</ns0:inchi_key_string>
    <ns0:inchi_string>InChI=1S/C23H45NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(27)28-21(19-22(25)26)20-24(2,3)4/h21H,5-20H2,1-4H3</ns0:inchi_string>
    <ns0:mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">399.616</ns0:mass>
    <ns0:monoisotopic_mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">399.33486</ns0:monoisotopic_mass>
    <ns0:smiles_string>CCCCCCCCCCCCCCCC(=O)OC(CC(=O)[O-])C[N+](C)(C)C</ns0:smiles_string>
    <skos:notation>CHEBI:73067</skos:notation>
    <obo_purl:IAO_0000115>An &lt;em&gt;O&lt;/em&gt;-acylcarnitine having palmitoyl (hexadecanoyl) as the acyl substituent.</obo_purl:IAO_0000115>
    <oboinowl_gen:hasExactSynonym>3-(hexadecanoyloxy)-4-(trimethylazaniumyl)butanoate</oboinowl_gen:hasExactSynonym>
    <oboinowl_gen:hasDbXref>cas:1935-18-8</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasDbXref>pubmed:23315938</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasDbXref>reaxys:4152032</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace>
    <oboinowl_gen:id>CHEBI:73067</oboinowl_gen:id>
    <oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi/3_STAR"/>
    <metadata_def:prefLabel>O-palmitoylcarnitine</metadata_def:prefLabel>
    <oboinowl_gen:hasRelatedSynonym>3-(hexadecanoyloxy)-4-(trimethylammonio)butanoate</oboinowl_gen:hasRelatedSynonym>
    <oboinowl_gen:hasRelatedSynonym>O-hexadecanoylcarnitine</oboinowl_gen:hasRelatedSynonym>
    <oboinowl_gen:hasRelatedSynonym>hexadecanoylcarnitine</oboinowl_gen:hasRelatedSynonym>
    <oboinowl_gen:hasRelatedSynonym>hexadecanoylcarnitines</oboinowl_gen:hasRelatedSynonym>
    <oboinowl_gen:hasRelatedSynonym>palmitoylcarnitine</oboinowl_gen:hasRelatedSynonym>
    <oboinowl_gen:hasRelatedSynonym>3-(hexadecanoyloxy)-4-(trimethylazaniumyl)butanoate</oboinowl_gen:hasRelatedSynonym>
    <metadata_def:mappingLoom>opalmitoylcarnitine</metadata_def:mappingLoom>
    <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_73067"/>
  </owl:Class>
  <rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_73067">
    <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_73067"/>
  </rdf:Description>
</rdf:RDF>