@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 oboinowl_gen: <http://www.geneontology.org/formats/oboInOwl#> .
@prefix ns0: <http://purl.obolibrary.org/obo/chebi#> .
@prefix ns1: <http://purl.obolibrary.org/obo#> .
@prefix metadata_def: <http://data.bioontology.org/metadata/def/> .
@prefix ns2: <http://purl.obolibrary.org/obo/chebi/> .
obo_purl:CHEBI_3440
metadata_def:mappingLoom "carvacrol" ;
metadata_def:mappingSameURI obo_purl:CHEBI_3440 ;
metadata_def:prefLabel "carvacrol" ;
ns1:has_role obo_purl:CHEBI_33281 ;
obo_purl:IAO_0000115 "A phenol that is a natural monoterpene derivative of cymene. An inhibitor of bacterial growth, it is used as a food additive. Potent activator of the human ion channels transient receptor potential V3 (TRPV3) and A1 (TRPA1)." ;
ns2:charge "0" ;
ns2:formula "C10H14O" ;
ns2:inchi "InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4-7,11H,1-3H3" ;
ns2:inchikey "RECUKUPTGUEGMW-UHFFFAOYSA-N" ;
ns2:mass "150.21760" ;
ns2:monoisotopicmass "150.10447" ;
ns2:smiles "CC(C)c1ccc(C)c(O)c1" ;
oboinowl_gen:hasDbXref "Beilstein:1860514", "CAS:499-75-2", "ChEMBL:138580", "ChemIDplus:1860514", "ChemIDplus:499-75-2", "CiteXplore:21447440", "CiteXplore:21544887", "CiteXplore:21815724", "CiteXplore:21879312", "CiteXplore:21938469", "CiteXplore:22002497", "CiteXplore:22129102", "CiteXplore:22139435", "CiteXplore:22183117", "CiteXplore:22273461", "CiteXplore:22289589", "CiteXplore:22305883", "CiteXplore:22308777", "CiteXplore:22328722", "KEGG COMPOUND:499-75-2", "KEGG COMPOUND:C09840", "KEGG:C09840", "KNApSAcK:C00000156", "LIPID_MAPS_instance:LMPR0102090017", "MESH:C073316", "NCIt:C83602", "NIST Chemistry WebBook:499-75-2", "PMID:21447440", "PMID:21544887", "PMID:21815724", "PMID:21879312", "PMID:21938469", "PMID:22002497", "PMID:22129102", "PMID:22139435", "PMID:22183117", "PMID:22273461", "PMID:22289589", "PMID:22305883", "PMID:22308777", "PMID:22328722", "SNOMEDCT:109231009", "Wikipedia:Carvacrol" ;
oboinowl_gen:hasExactSynonym "2-methyl-5-(propan-2-yl)phenol", "Carvacrol", "carvacrol" ;
oboinowl_gen:hasOBONamespace "chebi_ontology" ;
oboinowl_gen:hasRelatedSynonym "1-Hydroxy-2-methyl-5-isopropylbenzene", "1-Methyl-2-hydroxy-4-isopropylbenzene", "2-Hydroxy-p-cymene", "2-Methyl-5-(1-methylethyl)phenol", "2-Methyl-5-isopropylphenol", "2-p-Cymenol", "3-Isopropyl-6-methylphenol", "5-Isopropyl-2-methylphenol", "5-Isopropyl-o-cresol" ;
oboinowl_gen:id "CHEBI:3440" ;
oboinowl_gen:inSubset <http://purl.obolibrary.org/obo/chebi#3_STAR> ;
a owl:Class ;
rdfs:label "carvacrol" ;
rdfs:subClassOf obo_purl:CHEBI_24913, obo_purl:CHEBI_33853 ;
skos:notation "CHEBI:3440" .
@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 oboinowl_gen: <http://www.geneontology.org/formats/oboInOwl#> .
@prefix ns0: <http://purl.obolibrary.org/obo/chebi#> .
@prefix ns1: <http://purl.obolibrary.org/obo#> .
@prefix metadata_def: <http://data.bioontology.org/metadata/def/> .
@prefix ns2: <http://purl.obolibrary.org/obo/chebi/> .
obo_purl:CHEBI_3440
metadata_def:mappingLoom "carvacrol" ;
metadata_def:mappingSameURI obo_purl:CHEBI_3440 ;
metadata_def:prefLabel "carvacrol" ;
ns1:has_role obo_purl:CHEBI_33281 ;
obo_purl:IAO_0000115 "A phenol that is a natural monoterpene derivative of cymene. An inhibitor of bacterial growth, it is used as a food additive. Potent activator of the human ion channels transient receptor potential V3 (TRPV3) and A1 (TRPA1)." ;
ns2:charge "0" ;
ns2:formula "C10H14O" ;
ns2:inchi "InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4-7,11H,1-3H3" ;
ns2:inchikey "RECUKUPTGUEGMW-UHFFFAOYSA-N" ;
ns2:mass "150.21760" ;
ns2:monoisotopicmass "150.10447" ;
ns2:smiles "CC(C)c1ccc(C)c(O)c1" ;
oboinowl_gen:hasDbXref "Beilstein:1860514", "CAS:499-75-2", "ChEMBL:138580", "ChemIDplus:1860514", "ChemIDplus:499-75-2", "CiteXplore:21447440", "CiteXplore:21544887", "CiteXplore:21815724", "CiteXplore:21879312", "CiteXplore:21938469", "CiteXplore:22002497", "CiteXplore:22129102", "CiteXplore:22139435", "CiteXplore:22183117", "CiteXplore:22273461", "CiteXplore:22289589", "CiteXplore:22305883", "CiteXplore:22308777", "CiteXplore:22328722", "KEGG COMPOUND:499-75-2", "KEGG COMPOUND:C09840", "KEGG:C09840", "KNApSAcK:C00000156", "LIPID_MAPS_instance:LMPR0102090017", "MESH:C073316", "NCIt:C83602", "NIST Chemistry WebBook:499-75-2", "PMID:21447440", "PMID:21544887", "PMID:21815724", "PMID:21879312", "PMID:21938469", "PMID:22002497", "PMID:22129102", "PMID:22139435", "PMID:22183117", "PMID:22273461", "PMID:22289589", "PMID:22305883", "PMID:22308777", "PMID:22328722", "SNOMEDCT:109231009", "Wikipedia:Carvacrol" ;
oboinowl_gen:hasExactSynonym "2-methyl-5-(propan-2-yl)phenol", "Carvacrol", "carvacrol" ;
oboinowl_gen:hasOBONamespace "chebi_ontology" ;
oboinowl_gen:hasRelatedSynonym "1-Hydroxy-2-methyl-5-isopropylbenzene", "1-Methyl-2-hydroxy-4-isopropylbenzene", "2-Hydroxy-p-cymene", "2-Methyl-5-(1-methylethyl)phenol", "2-Methyl-5-isopropylphenol", "2-p-Cymenol", "3-Isopropyl-6-methylphenol", "5-Isopropyl-2-methylphenol", "5-Isopropyl-o-cresol" ;
oboinowl_gen:id "CHEBI:3440" ;
oboinowl_gen:inSubset <http://purl.obolibrary.org/obo/chebi#3_STAR> ;
a owl:Class ;
rdfs:label "carvacrol" ;
rdfs:subClassOf obo_purl:CHEBI_24913, obo_purl:CHEBI_33853 ;
skos:notation "CHEBI:3440" .