<?xml version="1.0" encoding="UTF-8"?> <rdf:RDF xmlns:rdf="http://www.w3.org/1999/02/22-rdf-syntax-ns#" xmlns:obo_purl="http://purl.obolibrary.org/obo/" xmlns:owl="http://www.w3.org/2002/07/owl#" xmlns:rdfs="http://www.w3.org/2000/01/rdf-schema#" xmlns:ns0="https://w3id.org/chemrof/" xmlns:skos="http://www.w3.org/2004/02/skos/core#" xmlns:oboinowl_gen="http://www.geneontology.org/formats/oboInOwl#" xmlns:metadata_def="http://data.bioontology.org/metadata/def/"> <owl:Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_4918"> <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_24431"/> <rdfs:label>O-methyleugenol</rdfs:label> <ns0:charge rdf:datatype="http://www.w3.org/2001/XMLSchema#integer">0</ns0:charge> <ns0:generalized_empirical_formula>C11H14O2</ns0:generalized_empirical_formula> <ns0:inchi_key_string>ZYEMGPIYFIJGTP-UHFFFAOYSA-N</ns0:inchi_key_string> <ns0:inchi_string>InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4,6-8H,1,5H2,2-3H3</ns0:inchi_string> <ns0:mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">178.231</ns0:mass> <ns0:monoisotopic_mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">178.09938</ns0:monoisotopic_mass> <ns0:smiles_string>C=CCc1ccc(OC)c(OC)c1</ns0:smiles_string> <skos:notation>CHEBI:4918</skos:notation> <oboinowl_gen:hasExactSynonym>1,2-dimethoxy-4-(prop-2-en-1-yl)benzene</oboinowl_gen:hasExactSynonym> <oboinowl_gen:hasDbXref>bpdb:2504</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>cas:93-15-2</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>kegg.compound:C10454</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>knapsack:C00002741</oboinowl_gen:hasDbXref> <oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace> <oboinowl_gen:id>CHEBI:4918</oboinowl_gen:id> <oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi/3_STAR"/> <metadata_def:prefLabel>O-methyleugenol</metadata_def:prefLabel> <oboinowl_gen:hasRelatedSynonym>1,2-Dimethoxy-4-(2-propenyl)benzene</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>1,2-dimethoxy-4-(prop-2-en-1-yl)benzene</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>Eugenol methyl ether</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>Methyl eugenol</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>Methyleugenol</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>O-Methyleugenol</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>O-methyleugenol</oboinowl_gen:hasRelatedSynonym> <metadata_def:mappingLoom>omethyleugenol</metadata_def:mappingLoom> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_4918"/> </owl:Class> <rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_4918"> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_4918"/> </rdf:Description> </rdf:RDF>
<?xml version="1.0" encoding="UTF-8"?>
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    <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_24431"/>
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    <ns0:charge rdf:datatype="http://www.w3.org/2001/XMLSchema#integer">0</ns0:charge>
    <ns0:generalized_empirical_formula>C11H14O2</ns0:generalized_empirical_formula>
    <ns0:inchi_key_string>ZYEMGPIYFIJGTP-UHFFFAOYSA-N</ns0:inchi_key_string>
    <ns0:inchi_string>InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4,6-8H,1,5H2,2-3H3</ns0:inchi_string>
    <ns0:mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">178.231</ns0:mass>
    <ns0:monoisotopic_mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">178.09938</ns0:monoisotopic_mass>
    <ns0:smiles_string>C=CCc1ccc(OC)c(OC)c1</ns0:smiles_string>
    <skos:notation>CHEBI:4918</skos:notation>
    <oboinowl_gen:hasExactSynonym>1,2-dimethoxy-4-(prop-2-en-1-yl)benzene</oboinowl_gen:hasExactSynonym>
    <oboinowl_gen:hasDbXref>bpdb:2504</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasDbXref>cas:93-15-2</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasDbXref>kegg.compound:C10454</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasDbXref>knapsack:C00002741</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace>
    <oboinowl_gen:id>CHEBI:4918</oboinowl_gen:id>
    <oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi/3_STAR"/>
    <metadata_def:prefLabel>O-methyleugenol</metadata_def:prefLabel>
    <oboinowl_gen:hasRelatedSynonym>1,2-Dimethoxy-4-(2-propenyl)benzene</oboinowl_gen:hasRelatedSynonym>
    <oboinowl_gen:hasRelatedSynonym>1,2-dimethoxy-4-(prop-2-en-1-yl)benzene</oboinowl_gen:hasRelatedSynonym>
    <oboinowl_gen:hasRelatedSynonym>Eugenol methyl ether</oboinowl_gen:hasRelatedSynonym>
    <oboinowl_gen:hasRelatedSynonym>Methyl eugenol</oboinowl_gen:hasRelatedSynonym>
    <oboinowl_gen:hasRelatedSynonym>Methyleugenol</oboinowl_gen:hasRelatedSynonym>
    <oboinowl_gen:hasRelatedSynonym>O-Methyleugenol</oboinowl_gen:hasRelatedSynonym>
    <oboinowl_gen:hasRelatedSynonym>O-methyleugenol</oboinowl_gen:hasRelatedSynonym>
    <metadata_def:mappingLoom>omethyleugenol</metadata_def:mappingLoom>
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  </owl:Class>
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