@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 ns0: <https://w3id.org/chemrof/> .
@prefix skos: <http://www.w3.org/2004/02/skos/core#> .
@prefix oboinowl_gen: <http://www.geneontology.org/formats/oboInOwl#> .
@prefix ns1: <http://purl.obolibrary.org/obo/chebi/> .
@prefix metadata_def: <http://data.bioontology.org/metadata/def/> .
obo_purl:CHEBI_73031
metadata_def:mappingLoom "omethylmalonylcarnitine" ;
metadata_def:mappingSameURI obo_purl:CHEBI_73031 ;
metadata_def:prefLabel "O-methylmalonylcarnitine" ;
obo_purl:IAO_0000115 "An <em>O</em>-acylcarnitine having methylmalonyl as the acyl substituent." ;
oboinowl_gen:hasAlternativeId "CHEBI:133074" ;
oboinowl_gen:hasDbXref "pubmed:23315938" ;
oboinowl_gen:hasExactSynonym "3-[(2-carboxypropanoyl)oxy]-4-(trimethylazaniumyl)butanoate" ;
oboinowl_gen:hasOBONamespace "chebi_ontology" ;
oboinowl_gen:hasRelatedSynonym "2-methylmalonyl carnitine", "2-methylmalonyl-D-carnitine", "2-methylmalonylcarnitine", "3-[(2-carboxypropanoyl)oxy]-4-(trimethylammonio)butanoate", "3-[(2-carboxypropanoyl)oxy]-4-(trimethylazaniumyl)butanoate", "methylmalonylcarnitine" ;
oboinowl_gen:id "CHEBI:73031" ;
oboinowl_gen:inSubset <http://purl.obolibrary.org/obo/chebi/3_STAR> ;
a owl:Class ;
rdfs:label "O-methylmalonylcarnitine" ;
rdfs:subClassOf obo_purl:CHEBI_24431 ;
skos:notation "CHEBI:73031" ;
ns0:charge 0 ;
ns0:generalized_empirical_formula "C11H19NO6" ;
ns0:inchi_key_string "XROYFEWIXXCPAW-UHFFFAOYSA-N" ;
ns0:inchi_string "InChI=1S/C11H19NO6/c1-7(10(15)16)11(17)18-8(5-9(13)14)6-12(2,3)4/h7-8H,5-6H2,1-4H3,(H-,13,14,15,16)" ;
ns0:mass 261.274 ;
ns0:monoisotopic_mass 261.12124 ;
ns0:smiles_string "CC(C(=O)O)C(=O)OC(CC(=O)[O-])C[N+](C)(C)C" .
@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 ns0: <https://w3id.org/chemrof/> .
@prefix skos: <http://www.w3.org/2004/02/skos/core#> .
@prefix oboinowl_gen: <http://www.geneontology.org/formats/oboInOwl#> .
@prefix ns1: <http://purl.obolibrary.org/obo/chebi/> .
@prefix metadata_def: <http://data.bioontology.org/metadata/def/> .
obo_purl:CHEBI_73031
metadata_def:mappingLoom "omethylmalonylcarnitine" ;
metadata_def:mappingSameURI obo_purl:CHEBI_73031 ;
metadata_def:prefLabel "O-methylmalonylcarnitine" ;
obo_purl:IAO_0000115 "An <em>O</em>-acylcarnitine having methylmalonyl as the acyl substituent." ;
oboinowl_gen:hasAlternativeId "CHEBI:133074" ;
oboinowl_gen:hasDbXref "pubmed:23315938" ;
oboinowl_gen:hasExactSynonym "3-[(2-carboxypropanoyl)oxy]-4-(trimethylazaniumyl)butanoate" ;
oboinowl_gen:hasOBONamespace "chebi_ontology" ;
oboinowl_gen:hasRelatedSynonym "2-methylmalonyl carnitine", "2-methylmalonyl-D-carnitine", "2-methylmalonylcarnitine", "3-[(2-carboxypropanoyl)oxy]-4-(trimethylammonio)butanoate", "3-[(2-carboxypropanoyl)oxy]-4-(trimethylazaniumyl)butanoate", "methylmalonylcarnitine" ;
oboinowl_gen:id "CHEBI:73031" ;
oboinowl_gen:inSubset <http://purl.obolibrary.org/obo/chebi/3_STAR> ;
a owl:Class ;
rdfs:label "O-methylmalonylcarnitine" ;
rdfs:subClassOf obo_purl:CHEBI_24431 ;
skos:notation "CHEBI:73031" ;
ns0:charge 0 ;
ns0:generalized_empirical_formula "C11H19NO6" ;
ns0:inchi_key_string "XROYFEWIXXCPAW-UHFFFAOYSA-N" ;
ns0:inchi_string "InChI=1S/C11H19NO6/c1-7(10(15)16)11(17)18-8(5-9(13)14)6-12(2,3)4/h7-8H,5-6H2,1-4H3,(H-,13,14,15,16)" ;
ns0:mass 261.274 ;
ns0:monoisotopic_mass 261.12124 ;
ns0:smiles_string "CC(C(=O)O)C(=O)OC(CC(=O)[O-])C[N+](C)(C)C" .