@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/C16H22O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/> .
obo_purl:CHEBI_34687
metadata_def:mappingLoom "dibutylphthalate" ;
metadata_def:mappingSameURI obo_purl:CHEBI_34687 ;
metadata_def:prefLabel "dibutyl phthalate" ;
obo_purl:IAO_0000115 "A phthalate ester that is the diester obtained by the formal condensation of the carboxy groups of phthalic acid with two molecules of butan-1-ol. Although used extensively as a plasticiser, it is a ubiquitous environmental contaminant that poses a risk to humans." ;
obo_purl:RO_0000087 obo_purl:CHEBI_25212, obo_purl:CHEBI_50905, obo_purl:CHEBI_67239, obo_purl:CHEBI_78298, obo_purl:CHEBI_79056 ;
ns0:has_functional_parent obo_purl:CHEBI_28885 ;
ns1:charge "0" ;
ns1:formula "C16H22O4" ;
ns1:inchi "InChI=1S/C16H22O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h7-10H,3-6,11-12H2,1-2H3" ;
ns1:inchikey "DOIRQSBPFJWKBE-UHFFFAOYSA-N" ;
ns1:mass "278.34350" ;
ns1:monoisotopicmass "278.15181" ;
ns1:smiles "CCCCOC(=O)c1ccccc1C(=O)OCCCC" ;
oboinowl_gen:hasAlternativeId "CHEBI:535597" ;
oboinowl_gen:hasDbXref "Beilstein:1914064", "CAS:84-74-2", "Drug_Central:4414", "Gmelin:262569", "HMDB:HMDB0033244", "KEGG:C14214", "PMID:11133400", "PMID:16232742", "PMID:19840837", "PMID:24213843", "PMID:24468924", "PMID:24616073", "PMID:26730679", "PMID:27655612", "PMID:28102498", "PMID:28363850", "PMID:28486587", "PMID:28566680", "PMID:28580302", "PMID:28753974", "PMID:28822891", "PMID:28823096", "PPDB:2924", "Reaxys:1914064", "Wikipedia:Dibutyl_phthalate" ;
oboinowl_gen:hasExactSynonym "Dibutyl phthalate", "dibutyl benzene-1,2-dicarboxylate" ;
oboinowl_gen:hasOBONamespace "chebi_ontology" ;
oboinowl_gen:hasRelatedSynonym "1,2-Benzenedicarboxylic acid dibutyl ester", "Benzene-o-dicarboxylic acid di-n-butyl ester", "Benzenedicarboxylic acid dibutyl ester", "Butyl phthalate", "DBP", "Di-n-butyl phthalate", "Dibutyl 1,2-benzenedicarboxylate", "Dibutyl o-phthalate", "Dibutyl-o-phthalate", "Phthalic acid di-n-butyl ester", "Phthalic acid dibutyl ester", "n-Butyl phthalate", "o-Benzenedicarboxylic acid dibutyl ester" ;
oboinowl_gen:id "CHEBI:34687" ;
oboinowl_gen:inSubset <http://purl.obolibrary.org/obo/chebi#3_STAR> ;
a owl:Class ;
rdfs:label "dibutyl phthalate" ;
rdfs:subClassOf obo_purl:CHEBI_35484, obo_purl:CHEBI_51307 ;
skos:notation "CHEBI:34687" .
obo_purl:ECTO_9000637
obo_purl:RO_0002309 obo_purl:CHEBI_34687 .
@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/C16H22O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/> .
obo_purl:CHEBI_34687
metadata_def:mappingLoom "dibutylphthalate" ;
metadata_def:mappingSameURI obo_purl:CHEBI_34687 ;
metadata_def:prefLabel "dibutyl phthalate" ;
obo_purl:IAO_0000115 "A phthalate ester that is the diester obtained by the formal condensation of the carboxy groups of phthalic acid with two molecules of butan-1-ol. Although used extensively as a plasticiser, it is a ubiquitous environmental contaminant that poses a risk to humans." ;
obo_purl:RO_0000087 obo_purl:CHEBI_25212, obo_purl:CHEBI_50905, obo_purl:CHEBI_67239, obo_purl:CHEBI_78298, obo_purl:CHEBI_79056 ;
ns0:has_functional_parent obo_purl:CHEBI_28885 ;
ns1:charge "0" ;
ns1:formula "C16H22O4" ;
ns1:inchi "InChI=1S/C16H22O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h7-10H,3-6,11-12H2,1-2H3" ;
ns1:inchikey "DOIRQSBPFJWKBE-UHFFFAOYSA-N" ;
ns1:mass "278.34350" ;
ns1:monoisotopicmass "278.15181" ;
ns1:smiles "CCCCOC(=O)c1ccccc1C(=O)OCCCC" ;
oboinowl_gen:hasAlternativeId "CHEBI:535597" ;
oboinowl_gen:hasDbXref "Beilstein:1914064", "CAS:84-74-2", "Drug_Central:4414", "Gmelin:262569", "HMDB:HMDB0033244", "KEGG:C14214", "PMID:11133400", "PMID:16232742", "PMID:19840837", "PMID:24213843", "PMID:24468924", "PMID:24616073", "PMID:26730679", "PMID:27655612", "PMID:28102498", "PMID:28363850", "PMID:28486587", "PMID:28566680", "PMID:28580302", "PMID:28753974", "PMID:28822891", "PMID:28823096", "PPDB:2924", "Reaxys:1914064", "Wikipedia:Dibutyl_phthalate" ;
oboinowl_gen:hasExactSynonym "Dibutyl phthalate", "dibutyl benzene-1,2-dicarboxylate" ;
oboinowl_gen:hasOBONamespace "chebi_ontology" ;
oboinowl_gen:hasRelatedSynonym "1,2-Benzenedicarboxylic acid dibutyl ester", "Benzene-o-dicarboxylic acid di-n-butyl ester", "Benzenedicarboxylic acid dibutyl ester", "Butyl phthalate", "DBP", "Di-n-butyl phthalate", "Dibutyl 1,2-benzenedicarboxylate", "Dibutyl o-phthalate", "Dibutyl-o-phthalate", "Phthalic acid di-n-butyl ester", "Phthalic acid dibutyl ester", "n-Butyl phthalate", "o-Benzenedicarboxylic acid dibutyl ester" ;
oboinowl_gen:id "CHEBI:34687" ;
oboinowl_gen:inSubset <http://purl.obolibrary.org/obo/chebi#3_STAR> ;
a owl:Class ;
rdfs:label "dibutyl phthalate" ;
rdfs:subClassOf obo_purl:CHEBI_35484, obo_purl:CHEBI_51307 ;
skos:notation "CHEBI:34687" .
obo_purl:ECTO_9000637
obo_purl:RO_0002309 obo_purl:CHEBI_34687 .