<?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: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_82913"> <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_33709"/> <skos:notation>CHEBI:82913</skos:notation> <obo_purl:IAO_0000115>A L-tyrosine derivative that is the 3-methoxy derivative of L-dopa.</obo_purl:IAO_0000115> <oboinowl_gen:hasExactSynonym>3-methoxy-L-tyrosine</oboinowl_gen:hasExactSynonym> <rdfs:label>3-O-methyldopa</rdfs:label> <oboinowl_gen:hasDbXref>CAS:300-48-1</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>HMDB:HMDB0001434</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>PDBeChem:3YM</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>PMID:23503547</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>PMID:24513538</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>Reaxys:2379987</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>Wikipedia:3-O-Methyldopa</oboinowl_gen:hasDbXref> <obo_purl:chebi/charge>0</obo_purl:chebi/charge> <obo_purl:chebi/formula>C10H13NO4</obo_purl:chebi/formula> <obo_purl:chebi/inchi>InChI=1S/C10H13NO4/c1-15-9-5-6(2-3-8(9)12)4-7(11)10(13)14/h2-3,5,7,12H,4,11H2,1H3,(H,13,14)/t7-/m0/s1</obo_purl:chebi/inchi> <obo_purl:chebi/inchikey>PFDUUKDQEHURQC-ZETCQYMHSA-N</obo_purl:chebi/inchikey> <obo_purl:chebi/mass>211.217</obo_purl:chebi/mass> <obo_purl:chebi/monoisotopicmass>211.08446</obo_purl:chebi/monoisotopicmass> <obo_purl:chebi/smiles>O=C(O)[C@@H](N)CC=1C=C(C(=CC1)O)OC</obo_purl:chebi/smiles> <metadata_def:prefLabel>3-O-methyldopa</metadata_def:prefLabel> <oboinowl_gen:hasRelatedSynonym>L-3-(4-hydroxy-3-methoxyphenyl)-alanine</oboinowl_gen:hasRelatedSynonym> <metadata_def:mappingLoom>3omethyldopa</metadata_def:mappingLoom> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_82913"/> <oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace> <oboinowl_gen:id>CHEBI:82913</oboinowl_gen:id> <oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi#3_STAR"/> </owl:Class> <rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_82913"> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_82913"/> </rdf:Description> </rdf:RDF>
<?xml version="1.0" encoding="UTF-8"?>
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    <oboinowl_gen:hasDbXref>HMDB:HMDB0001434</oboinowl_gen:hasDbXref>
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    <obo_purl:chebi/charge>0</obo_purl:chebi/charge>
    <obo_purl:chebi/formula>C10H13NO4</obo_purl:chebi/formula>
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    <obo_purl:chebi/inchikey>PFDUUKDQEHURQC-ZETCQYMHSA-N</obo_purl:chebi/inchikey>
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    <obo_purl:chebi/monoisotopicmass>211.08446</obo_purl:chebi/monoisotopicmass>
    <obo_purl:chebi/smiles>O=C(O)[C@@H](N)CC=1C=C(C(=CC1)O)OC</obo_purl:chebi/smiles>
    <metadata_def:prefLabel>3-O-methyldopa</metadata_def:prefLabel>
    <oboinowl_gen:hasRelatedSynonym>L-3-(4-hydroxy-3-methoxyphenyl)-alanine</oboinowl_gen:hasRelatedSynonym>
    <metadata_def:mappingLoom>3omethyldopa</metadata_def:mappingLoom>
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