<?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_16682"> <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_33575"/> <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_37622"/> <rdfs:label>N-acetyl-beta-alanine</rdfs:label> <skos:notation>CHEBI:16682</skos:notation> <obo_purl:IAO_0000115>The N-acetyl derivative of beta-alanine.</obo_purl:IAO_0000115> <oboinowl_gen:hasExactSynonym>3-acetamidopropanoic acid</oboinowl_gen:hasExactSynonym> <oboinowl_gen:hasExactSynonym>N-Acetyl-beta-alanine</oboinowl_gen:hasExactSynonym> <oboinowl_gen:hasDbXref>CAS:3025-95-4</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>Gmelin:1317687</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>KEGG:C01073</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>MetaCyc:CPD-580</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>Reaxys:1704093</oboinowl_gen:hasDbXref> <oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace> <oboinowl_gen:id>CHEBI:16682</oboinowl_gen:id> <oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi#3_STAR"/> <metadata_def:prefLabel>N-acetyl-beta-alanine</metadata_def:prefLabel> <oboinowl_gen:hasRelatedSynonym>3-(acetylamino)propanoic acid</oboinowl_gen:hasRelatedSynonym> <metadata_def:mappingLoom>nacetylbetaalanine</metadata_def:mappingLoom> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_16682"/> <oboinowl_gen:hasAlternativeId>CHEBI:12449</oboinowl_gen:hasAlternativeId> <oboinowl_gen:hasAlternativeId>CHEBI:21599</oboinowl_gen:hasAlternativeId> <oboinowl_gen:hasAlternativeId>CHEBI:7186</oboinowl_gen:hasAlternativeId> <obo_purl:chebi/charge>0</obo_purl:chebi/charge> <obo_purl:chebi/formula>C5H9NO3</obo_purl:chebi/formula> <obo_purl:chebi/inchi>InChI=1S/C5H9NO3/c1-4(7)6-3-2-5(8)9/h2-3H2,1H3,(H,6,7)(H,8,9)</obo_purl:chebi/inchi> <obo_purl:chebi/inchikey>LJLLAWRMBZNPMO-UHFFFAOYSA-N</obo_purl:chebi/inchikey> <obo_purl:chebi/mass>131.12990</obo_purl:chebi/mass> <obo_purl:chebi/monoisotopicmass>131.05824</obo_purl:chebi/monoisotopicmass> <obo_purl:chebi/smiles>CC(=O)NCCC(O)=O</obo_purl:chebi/smiles> </owl:Class> <rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_16682"> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_16682"/> </rdf:Description> </rdf:RDF>
<?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_16682">
    <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_33575"/>
    <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_37622"/>
    <rdfs:label>N-acetyl-beta-alanine</rdfs:label>
    <skos:notation>CHEBI:16682</skos:notation>
    <obo_purl:IAO_0000115>The N-acetyl derivative of beta-alanine.</obo_purl:IAO_0000115>
    <oboinowl_gen:hasExactSynonym>3-acetamidopropanoic acid</oboinowl_gen:hasExactSynonym>
    <oboinowl_gen:hasExactSynonym>N-Acetyl-beta-alanine</oboinowl_gen:hasExactSynonym>
    <oboinowl_gen:hasDbXref>CAS:3025-95-4</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasDbXref>Gmelin:1317687</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasDbXref>KEGG:C01073</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasDbXref>MetaCyc:CPD-580</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasDbXref>Reaxys:1704093</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace>
    <oboinowl_gen:id>CHEBI:16682</oboinowl_gen:id>
    <oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi#3_STAR"/>
    <metadata_def:prefLabel>N-acetyl-beta-alanine</metadata_def:prefLabel>
    <oboinowl_gen:hasRelatedSynonym>3-(acetylamino)propanoic acid</oboinowl_gen:hasRelatedSynonym>
    <metadata_def:mappingLoom>nacetylbetaalanine</metadata_def:mappingLoom>
    <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_16682"/>
    <oboinowl_gen:hasAlternativeId>CHEBI:12449</oboinowl_gen:hasAlternativeId>
    <oboinowl_gen:hasAlternativeId>CHEBI:21599</oboinowl_gen:hasAlternativeId>
    <oboinowl_gen:hasAlternativeId>CHEBI:7186</oboinowl_gen:hasAlternativeId>
    <obo_purl:chebi/charge>0</obo_purl:chebi/charge>
    <obo_purl:chebi/formula>C5H9NO3</obo_purl:chebi/formula>
    <obo_purl:chebi/inchi>InChI=1S/C5H9NO3/c1-4(7)6-3-2-5(8)9/h2-3H2,1H3,(H,6,7)(H,8,9)</obo_purl:chebi/inchi>
    <obo_purl:chebi/inchikey>LJLLAWRMBZNPMO-UHFFFAOYSA-N</obo_purl:chebi/inchikey>
    <obo_purl:chebi/mass>131.12990</obo_purl:chebi/mass>
    <obo_purl:chebi/monoisotopicmass>131.05824</obo_purl:chebi/monoisotopicmass>
    <obo_purl:chebi/smiles>CC(=O)NCCC(O)=O</obo_purl:chebi/smiles>
  </owl:Class>
  <rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_16682">
    <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_16682"/>
  </rdf:Description>
</rdf:RDF>