@prefix rdf: <http://www.w3.org/1999/02/22-rdf-syntax-ns#> . @prefix obo_purl: <http://purl.obolibrary.org/obo/> . @prefix owl: <http://www.w3.org/2002/07/owl#> . @prefix rdfs: <http://www.w3.org/2000/01/rdf-schema#> . @prefix skos: <http://www.w3.org/2004/02/skos/core#> . @prefix metadata_def: <http://data.bioontology.org/metadata/def/> . @prefix oboinowl_gen: <http://www.geneontology.org/formats/oboInOwl#> . @prefix ns0: <http://purl.obolibrary.org/obo/chebi#> . @prefix ns1: <http://purl.obolibrary.org/obo/chebi/> . @prefix ns2: <InChI=1S/C13H23NO6/c1-14(2,3)9-10(8-12(17)18)20-13(19)7-5-4-6-11(15)16/> . obo_purl:CHEBI_68568 metadata_def:mappingLoom "oadipoylcarnitine" ; metadata_def:mappingSameURI obo_purl:CHEBI_68568 ; metadata_def:prefLabel "O-adipoylcarnitine" ; obo_purl:IAO_0000115 "An O-acylcarnitine compound having adipoyl as the acyl substituent." ; ns1:charge "0" ; ns1:formula "C13H23NO6" ; ns1:inchi "InChI=1S/C13H23NO6/c1-14(2,3)9-10(8-12(17)18)20-13(19)7-5-4-6-11(15)16/h10H,4-9H2,1-3H3,(H-,15,16,17,18)" ; ns1:inchikey "BSVHAXJKBCWVDA-UHFFFAOYSA-N" ; ns1:mass "289.32480" ; ns1:monoisotopicmass "289.15254" ; ns1:smiles "C[N+](C)(C)CC(CC([O-])=O)OC(=O)CCCCC(O)=O" ; oboinowl_gen:hasDbXref "PMID:22770225", "PMID:23315938", "Reaxys:14657154" ; oboinowl_gen:hasExactSynonym "3-[(5-carboxypentanoyl)oxy]-4-(trimethylazaniumyl)butanoate" ; oboinowl_gen:hasOBONamespace "chebi_ontology" ; oboinowl_gen:hasRelatedSynonym "3-[(5-carboxypentanoyl)oxy]-4-(trimethylammonio)butanoate" ; oboinowl_gen:id "CHEBI:68568" ; oboinowl_gen:inSubset <http://purl.obolibrary.org/obo/chebi#3_STAR> ; a owl:Class ; rdfs:label "O-adipoylcarnitine" ; rdfs:subClassOf obo_purl:CHEBI_24431 ; skos:notation "CHEBI:68568" .
@prefix rdf: <http://www.w3.org/1999/02/22-rdf-syntax-ns#> .
@prefix obo_purl: <http://purl.obolibrary.org/obo/> .
@prefix owl: <http://www.w3.org/2002/07/owl#> .
@prefix rdfs: <http://www.w3.org/2000/01/rdf-schema#> .
@prefix skos: <http://www.w3.org/2004/02/skos/core#> .
@prefix metadata_def: <http://data.bioontology.org/metadata/def/> .
@prefix oboinowl_gen: <http://www.geneontology.org/formats/oboInOwl#> .
@prefix ns0: <http://purl.obolibrary.org/obo/chebi#> .
@prefix ns1: <http://purl.obolibrary.org/obo/chebi/> .
@prefix ns2: <InChI=1S/C13H23NO6/c1-14(2,3)9-10(8-12(17)18)20-13(19)7-5-4-6-11(15)16/> .

obo_purl:CHEBI_68568
    metadata_def:mappingLoom "oadipoylcarnitine" ;
    metadata_def:mappingSameURI obo_purl:CHEBI_68568 ;
    metadata_def:prefLabel "O-adipoylcarnitine" ;
    obo_purl:IAO_0000115 "An O-acylcarnitine compound having adipoyl as the acyl substituent." ;
    ns1:charge "0" ;
    ns1:formula "C13H23NO6" ;
    ns1:inchi "InChI=1S/C13H23NO6/c1-14(2,3)9-10(8-12(17)18)20-13(19)7-5-4-6-11(15)16/h10H,4-9H2,1-3H3,(H-,15,16,17,18)" ;
    ns1:inchikey "BSVHAXJKBCWVDA-UHFFFAOYSA-N" ;
    ns1:mass "289.32480" ;
    ns1:monoisotopicmass "289.15254" ;
    ns1:smiles "C[N+](C)(C)CC(CC([O-])=O)OC(=O)CCCCC(O)=O" ;
    oboinowl_gen:hasDbXref "PMID:22770225", "PMID:23315938", "Reaxys:14657154" ;
    oboinowl_gen:hasExactSynonym "3-[(5-carboxypentanoyl)oxy]-4-(trimethylazaniumyl)butanoate" ;
    oboinowl_gen:hasOBONamespace "chebi_ontology" ;
    oboinowl_gen:hasRelatedSynonym "3-[(5-carboxypentanoyl)oxy]-4-(trimethylammonio)butanoate" ;
    oboinowl_gen:id "CHEBI:68568" ;
    oboinowl_gen:inSubset <http://purl.obolibrary.org/obo/chebi#3_STAR> ;
    a owl:Class ;
    rdfs:label "O-adipoylcarnitine" ;
    rdfs:subClassOf obo_purl:CHEBI_24431 ;
    skos:notation "CHEBI:68568" .