<?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:metadata_def="http://data.bioontology.org/metadata/def/" xmlns:oboinowl_gen="http://www.geneontology.org/formats/oboInOwl#" xmlns:metadata="http://data.bioontology.org/metadata/" xmlns:ns0="http://purl.obolibrary.org/obo/chebi#"> <owl:Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_63894"> <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_35757"/> <skos:notation>CHEBI:63894</skos:notation> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_63894"/> <metadata_def:mappingLoom>pivalate</metadata_def:mappingLoom> <rdfs:label>pivalate</rdfs:label> <metadata_def:prefLabel>pivalate</metadata_def:prefLabel> <oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi#3_STAR"/> <oboinowl_gen:hasExactSynonym>2,2-dimethylpropanoate</oboinowl_gen:hasExactSynonym> <obo_purl:IAO_0000115>A monocarboxylic acid anion resulting from the removal of a proton from the carboxy group of pivalic acid.</obo_purl:IAO_0000115> <oboinowl_gen:id>CHEBI:63894</oboinowl_gen:id> <oboinowl_gen:hasRelatedSynonym>trimethylacetate</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>alpha,alpha-dimethylpropanoate</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>neopentanoate</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>alpha,alpha-dimethylpropionate</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>2,2-dimethylpropionate</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasDbXref>Reaxys:3601483</oboinowl_gen:hasDbXref> <oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace> <metadata:treeView rdf:resource="http://purl.obolibrary.org/obo/CHEBI_35757"/> <obo_purl:chebi/smiles>CC(C)(C)C([O-])=O</obo_purl:chebi/smiles> <ns0:is_conjugate_base_of rdf:resource="http://purl.obolibrary.org/obo/CHEBI_45133"/> <obo_purl:chebi/formula>C5H9O2</obo_purl:chebi/formula> <obo_purl:chebi/charge>-1</obo_purl:chebi/charge> <obo_purl:chebi/mass>101.12380</obo_purl:chebi/mass> <obo_purl:chebi/inchikey>IUGYQRQAERSCNH-UHFFFAOYSA-M</obo_purl:chebi/inchikey> <obo_purl:chebi/monoisotopicmass>101.06080</obo_purl:chebi/monoisotopicmass> <obo_purl:chebi/inchi>InChI=1S/C5H10O2/c1-5(2,3)4(6)7/h1-3H3,(H,6,7)/p-1</obo_purl:chebi/inchi> </owl:Class> <rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_45133"> <ns0:is_conjugate_acid_of> <rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_63894"> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_63894"/> </rdf:Description> </ns0:is_conjugate_acid_of> </rdf:Description> <rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_63883"> <obo_purl:BFO_0000051 rdf:resource="http://purl.obolibrary.org/obo/CHEBI_63894"/> </rdf:Description> </rdf:RDF>