<?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_174593">
<rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_24431"/>
<rdfs:label>Glutaconylcarnitine</rdfs:label>
<ns0:charge rdf:datatype="http://www.w3.org/2001/XMLSchema#integer">0</ns0:charge>
<ns0:generalized_empirical_formula>C12H19NO6</ns0:generalized_empirical_formula>
<ns0:inchi_key_string>JXVUHLILXGZLFR-DNQSNQRASA-N</ns0:inchi_key_string>
<ns0:inchi_string>InChI=1S/C12H19NO6/c1-13(2,3)8-9(7-11(16)17)19-12(18)6-4-5-10(14)15/h4,6,9H,5,7-8H2,1-3H3,(H-,14,15,16,17)/b6-4+/t9-/m0/s1</ns0:inchi_string>
<ns0:mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">273.285</ns0:mass>
<ns0:monoisotopic_mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">273.12124</ns0:monoisotopic_mass>
<ns0:smiles_string>C[N+](C)(C)C[C@H](CC(=O)[O-])OC(=O)/C=C/CC(=O)O</ns0:smiles_string>
<skos:notation>CHEBI:174593</skos:notation>
<oboinowl_gen:hasExactSynonym>(3S)-3-[(E)-4-carboxybut-2-enoyl]oxy-4-(trimethylazaniumyl)butanoate</oboinowl_gen:hasExactSynonym>
<oboinowl_gen:hasDbXref>chemspider:30776696</oboinowl_gen:hasDbXref>
<oboinowl_gen:hasDbXref>hmdb:HMDB0013129</oboinowl_gen:hasDbXref>
<oboinowl_gen:hasDbXref>lipidmaps:LMFA07070065</oboinowl_gen:hasDbXref>
<oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace>
<oboinowl_gen:id>CHEBI:174593</oboinowl_gen:id>
<oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi/2_STAR"/>
<metadata_def:prefLabel>Glutaconylcarnitine</metadata_def:prefLabel>
<oboinowl_gen:hasRelatedSynonym>(3S)-3-[(E)-4-carboxybut-2-enoyl]oxy-4-(trimethylazaniumyl)butanoate</oboinowl_gen:hasRelatedSynonym>
<metadata_def:mappingLoom>glutaconylcarnitine</metadata_def:mappingLoom>
<metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_174593"/>
</owl:Class>
<rdf:Description rdf:about="http://www.ebi.ac.uk/efo/EFO_0801237">
<obo_purl:IAO_0000136>
<rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_174593">
<metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_174593"/>
</rdf:Description>
</obo_purl:IAO_0000136>
</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_174593">
<rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_24431"/>
<rdfs:label>Glutaconylcarnitine</rdfs:label>
<ns0:charge rdf:datatype="http://www.w3.org/2001/XMLSchema#integer">0</ns0:charge>
<ns0:generalized_empirical_formula>C12H19NO6</ns0:generalized_empirical_formula>
<ns0:inchi_key_string>JXVUHLILXGZLFR-DNQSNQRASA-N</ns0:inchi_key_string>
<ns0:inchi_string>InChI=1S/C12H19NO6/c1-13(2,3)8-9(7-11(16)17)19-12(18)6-4-5-10(14)15/h4,6,9H,5,7-8H2,1-3H3,(H-,14,15,16,17)/b6-4+/t9-/m0/s1</ns0:inchi_string>
<ns0:mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">273.285</ns0:mass>
<ns0:monoisotopic_mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">273.12124</ns0:monoisotopic_mass>
<ns0:smiles_string>C[N+](C)(C)C[C@H](CC(=O)[O-])OC(=O)/C=C/CC(=O)O</ns0:smiles_string>
<skos:notation>CHEBI:174593</skos:notation>
<oboinowl_gen:hasExactSynonym>(3S)-3-[(E)-4-carboxybut-2-enoyl]oxy-4-(trimethylazaniumyl)butanoate</oboinowl_gen:hasExactSynonym>
<oboinowl_gen:hasDbXref>chemspider:30776696</oboinowl_gen:hasDbXref>
<oboinowl_gen:hasDbXref>hmdb:HMDB0013129</oboinowl_gen:hasDbXref>
<oboinowl_gen:hasDbXref>lipidmaps:LMFA07070065</oboinowl_gen:hasDbXref>
<oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace>
<oboinowl_gen:id>CHEBI:174593</oboinowl_gen:id>
<oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi/2_STAR"/>
<metadata_def:prefLabel>Glutaconylcarnitine</metadata_def:prefLabel>
<oboinowl_gen:hasRelatedSynonym>(3S)-3-[(E)-4-carboxybut-2-enoyl]oxy-4-(trimethylazaniumyl)butanoate</oboinowl_gen:hasRelatedSynonym>
<metadata_def:mappingLoom>glutaconylcarnitine</metadata_def:mappingLoom>
<metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_174593"/>
</owl:Class>
<rdf:Description rdf:about="http://www.ebi.ac.uk/efo/EFO_0801237">
<obo_purl:IAO_0000136>
<rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_174593">
<metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_174593"/>
</rdf:Description>
</obo_purl:IAO_0000136>
</rdf:Description>
</rdf:RDF>