<?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:metadata_def="http://data.bioontology.org/metadata/def/" xmlns:oboinowl_gen="http://www.geneontology.org/formats/oboInOwl#" xmlns:skos="http://www.w3.org/2004/02/skos/core#" xmlns:metadata="http://data.bioontology.org/metadata/"> <owl:Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_72715"> <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_86480"/> <rdfs:label>O-linoelaidylcarnitine</rdfs:label> <obo_purl:chebi/charge>0</obo_purl:chebi/charge> <obo_purl:chebi/formula>C25H45NO4</obo_purl:chebi/formula> <obo_purl:chebi/inchi>InChI=1S/C25H45NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(29)30-23(21-24(27)28)22-26(2,3)4/h9-10,12-13,23H,5-8,11,14-22H2,1-4H3/b10-9+,13-12+</obo_purl:chebi/inchi> <obo_purl:chebi/inchikey>MJLXQSQYKZWZCB-OKLKQMLOSA-N</obo_purl:chebi/inchikey> <obo_purl:chebi/mass>423.62910</obo_purl:chebi/mass> <obo_purl:chebi/monoisotopicmass>423.33486</obo_purl:chebi/monoisotopicmass> <obo_purl:chebi/smiles>CCCCC\C=C\C\C=C\CCCCCCCC(=O)OC(CC([O-])=O)C[N+](C)(C)C</obo_purl:chebi/smiles> <metadata_def:prefLabel>O-linoelaidylcarnitine</metadata_def:prefLabel> <obo_purl:IAO_0000115>An O-octadecadienoylcarnitine having linoelaidyl as the acyl substituent.</obo_purl:IAO_0000115> <oboinowl_gen:hasExactSynonym>3-[(9E,12E)-octadeca-9,12-dienoyloxy]-4-(trimethylazaniumyl)butanoate</oboinowl_gen:hasExactSynonym> <oboinowl_gen:hasRelatedSynonym>3-[(9E,12E)-octadeca-9,12-dienoyloxy]-4-(trimethylammonio)butanoate</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>Acylcarnitine C18:2</oboinowl_gen:hasRelatedSynonym> <metadata_def:mappingLoom>olinoelaidylcarnitine</metadata_def:mappingLoom> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_72715"/> <oboinowl_gen:hasDbXref>PMID:23078175</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>HMDB:HMDB0006461</oboinowl_gen:hasDbXref> <oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace> <oboinowl_gen:id>CHEBI:72715</oboinowl_gen:id> <skos:notation>CHEBI:72715</skos:notation> <metadata:treeView rdf:resource="http://purl.obolibrary.org/obo/CHEBI_86480"/> <oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi#3_STAR"/> </owl:Class> <rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_72715"> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_72715"/> </rdf:Description> </rdf:RDF>
<?xml version="1.0" encoding="UTF-8"?>
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    <obo_purl:chebi/formula>C25H45NO4</obo_purl:chebi/formula>
    <obo_purl:chebi/inchi>InChI=1S/C25H45NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(29)30-23(21-24(27)28)22-26(2,3)4/h9-10,12-13,23H,5-8,11,14-22H2,1-4H3/b10-9+,13-12+</obo_purl:chebi/inchi>
    <obo_purl:chebi/inchikey>MJLXQSQYKZWZCB-OKLKQMLOSA-N</obo_purl:chebi/inchikey>
    <obo_purl:chebi/mass>423.62910</obo_purl:chebi/mass>
    <obo_purl:chebi/monoisotopicmass>423.33486</obo_purl:chebi/monoisotopicmass>
    <obo_purl:chebi/smiles>CCCCC\C=C\C\C=C\CCCCCCCC(=O)OC(CC([O-])=O)C[N+](C)(C)C</obo_purl:chebi/smiles>
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    <oboinowl_gen:hasExactSynonym>3-[(9E,12E)-octadeca-9,12-dienoyloxy]-4-(trimethylazaniumyl)butanoate</oboinowl_gen:hasExactSynonym>
    <oboinowl_gen:hasRelatedSynonym>3-[(9E,12E)-octadeca-9,12-dienoyloxy]-4-(trimethylammonio)butanoate</oboinowl_gen:hasRelatedSynonym>
    <oboinowl_gen:hasRelatedSynonym>Acylcarnitine C18:2</oboinowl_gen:hasRelatedSynonym>
    <metadata_def:mappingLoom>olinoelaidylcarnitine</metadata_def:mappingLoom>
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