@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/C13H25NO4/c1-5-6-7-8-13(17)18-11(9-12(15)16)10-14(2,3)4/> .
obo_purl:CHEBI_70749
metadata_def:mappingLoom "ohexanoylcarnitine" ;
metadata_def:mappingSameURI obo_purl:CHEBI_70749 ;
metadata_def:prefLabel "O-hexanoylcarnitine" ;
obo_purl:IAO_0000115 "An O-acylcarnitine compound having hexanoyl as the acyl substituent." ;
ns1:charge "0" ;
ns1:formula "C13H25NO4" ;
ns1:inchi "InChI=1S/C13H25NO4/c1-5-6-7-8-13(17)18-11(9-12(15)16)10-14(2,3)4/h11H,5-10H2,1-4H3" ;
ns1:inchikey "VVPRQWTYSNDTEA-UHFFFAOYSA-N" ;
ns1:mass "259.342" ;
ns1:monoisotopicmass "259.17836" ;
ns1:smiles "C(OC(CCCCC)=O)(C[N+](C)(C)C)CC(=O)[O-]" ;
oboinowl_gen:hasDbXref "CAS:6418-78-6", "HMDB:HMDB0000705", "PMID:22770225", "Reaxys:1883044" ;
oboinowl_gen:hasExactSynonym "3-(hexanoyloxy)-4-(trimethylazaniumyl)butanoate" ;
oboinowl_gen:hasOBONamespace "chebi_ontology" ;
oboinowl_gen:hasRelatedSynonym "3-(hexanoyloxy)-4-(trimethylammonio)butanoate", "hexanoylcarnitine" ;
oboinowl_gen:id "CHEBI:70749" ;
oboinowl_gen:inSubset <http://purl.obolibrary.org/obo/chebi#3_STAR> ;
a owl:Class ;
rdfs:label "O-hexanoylcarnitine" ;
rdfs:subClassOf obo_purl:CHEBI_18059 ;
skos:notation "CHEBI:70749" .
@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/C13H25NO4/c1-5-6-7-8-13(17)18-11(9-12(15)16)10-14(2,3)4/> .
obo_purl:CHEBI_70749
metadata_def:mappingLoom "ohexanoylcarnitine" ;
metadata_def:mappingSameURI obo_purl:CHEBI_70749 ;
metadata_def:prefLabel "O-hexanoylcarnitine" ;
obo_purl:IAO_0000115 "An O-acylcarnitine compound having hexanoyl as the acyl substituent." ;
ns1:charge "0" ;
ns1:formula "C13H25NO4" ;
ns1:inchi "InChI=1S/C13H25NO4/c1-5-6-7-8-13(17)18-11(9-12(15)16)10-14(2,3)4/h11H,5-10H2,1-4H3" ;
ns1:inchikey "VVPRQWTYSNDTEA-UHFFFAOYSA-N" ;
ns1:mass "259.342" ;
ns1:monoisotopicmass "259.17836" ;
ns1:smiles "C(OC(CCCCC)=O)(C[N+](C)(C)C)CC(=O)[O-]" ;
oboinowl_gen:hasDbXref "CAS:6418-78-6", "HMDB:HMDB0000705", "PMID:22770225", "Reaxys:1883044" ;
oboinowl_gen:hasExactSynonym "3-(hexanoyloxy)-4-(trimethylazaniumyl)butanoate" ;
oboinowl_gen:hasOBONamespace "chebi_ontology" ;
oboinowl_gen:hasRelatedSynonym "3-(hexanoyloxy)-4-(trimethylammonio)butanoate", "hexanoylcarnitine" ;
oboinowl_gen:id "CHEBI:70749" ;
oboinowl_gen:inSubset <http://purl.obolibrary.org/obo/chebi#3_STAR> ;
a owl:Class ;
rdfs:label "O-hexanoylcarnitine" ;
rdfs:subClassOf obo_purl:CHEBI_18059 ;
skos:notation "CHEBI:70749" .