@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/C2H3ClO2/c3-1-2(4)5/> .
obo_purl:CHEBI_23123
ns0:is_conjugate_base_of obo_purl:CHEBI_27869 .
obo_purl:CHEBI_27869
metadata_def:mappingLoom "chloroaceticacid" ;
metadata_def:mappingSameURI obo_purl:CHEBI_27869 ;
metadata_def:prefLabel "chloroacetic acid" ;
obo_purl:IAO_0000115 "A chlorocarboxylic acid that is acetic acid carrying a 2-chloro substituent." ;
obo_purl:RO_0000087 obo_purl:CHEBI_22333, obo_purl:CHEBI_24527 ;
ns0:is_conjugate_acid_of obo_purl:CHEBI_23123 ;
ns1:charge "0" ;
ns1:formula "C2H3ClO2" ;
ns1:inchi "InChI=1S/C2H3ClO2/c3-1-2(4)5/h1H2,(H,4,5)" ;
ns1:inchikey "FOCAUTSVDIKZOP-UHFFFAOYSA-N" ;
ns1:mass "94.49700" ;
ns1:monoisotopicmass "93.98216" ;
ns1:smiles "OC(=O)CCl" ;
oboinowl_gen:hasAlternativeId "CHEBI:23125", "CHEBI:3622" ;
oboinowl_gen:hasDbXref "CAS:79-11-8", "HMDB:HMDB0031331", "KEGG:C06755", "KEGG:D07677", "LIPID_MAPS_instance:LMFA01090068", "MetaCyc:CHLOROACETIC-ACID", "PDBeChem:R3W", "PMID:12359395", "PMID:15033542", "PMID:16647117", "PMID:17490874", "PMID:23103613", "PMID:25451595", "Pesticides:monochloroacetic%20acid", "Reaxys:605438" ;
oboinowl_gen:hasExactSynonym "Chloroacetic acid", "chloroacetic acid" ;
oboinowl_gen:hasOBONamespace "chebi_ontology" ;
oboinowl_gen:hasRelatedSynonym "2-chloro-acetic acid", "2-chloro-ethanoic acid", "2-chloroacetic acid", "Acide chloracetique", "Acide chloroacetique", "Acide monochloracetique", "CAA", "Chloroethanoic acid", "Monochloressigsaeure", "alpha-chloro-acetic acid", "chloracetic acid", "monochloroacetic acid", "monochloroethanoic acid" ;
oboinowl_gen:id "CHEBI:27869" ;
oboinowl_gen:inSubset <http://purl.obolibrary.org/obo/chebi#3_STAR> ;
a owl:Class ;
rdfs:label "chloroacetic acid" ;
rdfs:subClassOf obo_purl:CHEBI_16277, obo_purl:CHEBI_36685 ;
skos:notation "CHEBI:27869" .
obo_purl:ECTO_0001659
obo_purl:RO_0002309 obo_purl:CHEBI_27869 .
@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/C2H3ClO2/c3-1-2(4)5/> .
obo_purl:CHEBI_23123
ns0:is_conjugate_base_of obo_purl:CHEBI_27869 .
obo_purl:CHEBI_27869
metadata_def:mappingLoom "chloroaceticacid" ;
metadata_def:mappingSameURI obo_purl:CHEBI_27869 ;
metadata_def:prefLabel "chloroacetic acid" ;
obo_purl:IAO_0000115 "A chlorocarboxylic acid that is acetic acid carrying a 2-chloro substituent." ;
obo_purl:RO_0000087 obo_purl:CHEBI_22333, obo_purl:CHEBI_24527 ;
ns0:is_conjugate_acid_of obo_purl:CHEBI_23123 ;
ns1:charge "0" ;
ns1:formula "C2H3ClO2" ;
ns1:inchi "InChI=1S/C2H3ClO2/c3-1-2(4)5/h1H2,(H,4,5)" ;
ns1:inchikey "FOCAUTSVDIKZOP-UHFFFAOYSA-N" ;
ns1:mass "94.49700" ;
ns1:monoisotopicmass "93.98216" ;
ns1:smiles "OC(=O)CCl" ;
oboinowl_gen:hasAlternativeId "CHEBI:23125", "CHEBI:3622" ;
oboinowl_gen:hasDbXref "CAS:79-11-8", "HMDB:HMDB0031331", "KEGG:C06755", "KEGG:D07677", "LIPID_MAPS_instance:LMFA01090068", "MetaCyc:CHLOROACETIC-ACID", "PDBeChem:R3W", "PMID:12359395", "PMID:15033542", "PMID:16647117", "PMID:17490874", "PMID:23103613", "PMID:25451595", "Pesticides:monochloroacetic%20acid", "Reaxys:605438" ;
oboinowl_gen:hasExactSynonym "Chloroacetic acid", "chloroacetic acid" ;
oboinowl_gen:hasOBONamespace "chebi_ontology" ;
oboinowl_gen:hasRelatedSynonym "2-chloro-acetic acid", "2-chloro-ethanoic acid", "2-chloroacetic acid", "Acide chloracetique", "Acide chloroacetique", "Acide monochloracetique", "CAA", "Chloroethanoic acid", "Monochloressigsaeure", "alpha-chloro-acetic acid", "chloracetic acid", "monochloroacetic acid", "monochloroethanoic acid" ;
oboinowl_gen:id "CHEBI:27869" ;
oboinowl_gen:inSubset <http://purl.obolibrary.org/obo/chebi#3_STAR> ;
a owl:Class ;
rdfs:label "chloroacetic acid" ;
rdfs:subClassOf obo_purl:CHEBI_16277, obo_purl:CHEBI_36685 ;
skos:notation "CHEBI:27869" .
obo_purl:ECTO_0001659
obo_purl:RO_0002309 obo_purl:CHEBI_27869 .