<?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_176648">
<rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_24431"/>
<rdfs:label>Valine-d8</rdfs:label>
<ns0:charge rdf:datatype="http://www.w3.org/2001/XMLSchema#integer">0</ns0:charge>
<ns0:generalized_empirical_formula>C5H3D8NO2</ns0:generalized_empirical_formula>
<ns0:inchi_key_string>KZSNJWFQEVHDMF-RGZIBPOXSA-N</ns0:inchi_key_string>
<ns0:inchi_string>InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m0/s1/i1D,2D3,3D,4D/hD2/t3?,4-</ns0:inchi_string>
<ns0:mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">125.197</ns0:mass>
<ns0:monoisotopic_mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">125.12919</ns0:monoisotopic_mass>
<ns0:smiles_string>[2H]CC([2H])(C([2H])([2H])[2H])[C@@]([2H])(C(=O)O)N([2H])[2H]</ns0:smiles_string>
<skos:notation>CHEBI:176648</skos:notation>
<oboinowl_gen:hasExactSynonym>(2S)-2,3,4,4,4-pentadeuterio-3-(deuteriomethyl)-2-(dideuterioamino)butanoic acid</oboinowl_gen:hasExactSynonym>
<oboinowl_gen:hasDbXref>chemspider:65998480</oboinowl_gen:hasDbXref>
<oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace>
<oboinowl_gen:id>CHEBI:176648</oboinowl_gen:id>
<oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi/2_STAR"/>
<metadata_def:prefLabel>Valine-d8</metadata_def:prefLabel>
<oboinowl_gen:hasRelatedSynonym>(2S)-2,3,4,4,4-pentadeuterio-3-(deuteriomethyl)-2-(dideuterioamino)butanoic acid</oboinowl_gen:hasRelatedSynonym>
<metadata_def:mappingLoom>valined8</metadata_def:mappingLoom>
<metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_176648"/>
</owl:Class>
<rdf:Description rdf:about="http://www.ebi.ac.uk/efo/EFO_0801223">
<obo_purl:IAO_0000136>
<rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_176648">
<metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_176648"/>
</rdf:Description>
</obo_purl:IAO_0000136>
</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: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_176648">
<rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_24431"/>
<rdfs:label>Valine-d8</rdfs:label>
<ns0:charge rdf:datatype="http://www.w3.org/2001/XMLSchema#integer">0</ns0:charge>
<ns0:generalized_empirical_formula>C5H3D8NO2</ns0:generalized_empirical_formula>
<ns0:inchi_key_string>KZSNJWFQEVHDMF-RGZIBPOXSA-N</ns0:inchi_key_string>
<ns0:inchi_string>InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m0/s1/i1D,2D3,3D,4D/hD2/t3?,4-</ns0:inchi_string>
<ns0:mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">125.197</ns0:mass>
<ns0:monoisotopic_mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">125.12919</ns0:monoisotopic_mass>
<ns0:smiles_string>[2H]CC([2H])(C([2H])([2H])[2H])[C@@]([2H])(C(=O)O)N([2H])[2H]</ns0:smiles_string>
<skos:notation>CHEBI:176648</skos:notation>
<oboinowl_gen:hasExactSynonym>(2S)-2,3,4,4,4-pentadeuterio-3-(deuteriomethyl)-2-(dideuterioamino)butanoic acid</oboinowl_gen:hasExactSynonym>
<oboinowl_gen:hasDbXref>chemspider:65998480</oboinowl_gen:hasDbXref>
<oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace>
<oboinowl_gen:id>CHEBI:176648</oboinowl_gen:id>
<oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi/2_STAR"/>
<metadata_def:prefLabel>Valine-d8</metadata_def:prefLabel>
<oboinowl_gen:hasRelatedSynonym>(2S)-2,3,4,4,4-pentadeuterio-3-(deuteriomethyl)-2-(dideuterioamino)butanoic acid</oboinowl_gen:hasRelatedSynonym>
<metadata_def:mappingLoom>valined8</metadata_def:mappingLoom>
<metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_176648"/>
</owl:Class>
<rdf:Description rdf:about="http://www.ebi.ac.uk/efo/EFO_0801223">
<obo_purl:IAO_0000136>
<rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_176648">
<metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_176648"/>
</rdf:Description>
</obo_purl:IAO_0000136>
</rdf:Description>
</rdf:RDF>