<?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/"> <owl:Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_82114"> <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_37512"/> <skos:notation>CHEBI:82114</skos:notation> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_82114"/> <metadata_def:mappingLoom>demephiono</metadata_def:mappingLoom> <rdfs:label>Demephion-O</rdfs:label> <metadata_def:prefLabel>Demephion-O</metadata_def:prefLabel> <oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi#2_STAR"/> <oboinowl_gen:hasDbXref>PPDB:2756</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>CAS:682-80-4</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>KEGG:C18975</oboinowl_gen:hasDbXref> <oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace> <metadata:treeView rdf:resource="http://purl.obolibrary.org/obo/CHEBI_37512"/> <oboinowl_gen:id>CHEBI:82114</oboinowl_gen:id> <obo_purl:chebi/smiles>COP(=S)(OC)OCCSC</obo_purl:chebi/smiles> <obo_purl:chebi/formula>C5H13O3PS2</obo_purl:chebi/formula> <obo_purl:chebi/charge>0</obo_purl:chebi/charge> <obo_purl:chebi/mass>216.25900</obo_purl:chebi/mass> <obo_purl:chebi/inchikey>IATBEFPCSHFQJS-UHFFFAOYSA-N</obo_purl:chebi/inchikey> <obo_purl:chebi/monoisotopicmass>216.00437</obo_purl:chebi/monoisotopicmass> <obo_purl:chebi/inchi>InChI=1S/C5H13O3PS2/c1-6-9(10,7-2)8-4-5-11-3/h4-5H2,1-3H3</obo_purl:chebi/inchi> </owl:Class> <rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_82114"> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_82114"/> </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:metadata_def="http://data.bioontology.org/metadata/def/" xmlns:oboinowl_gen="http://www.geneontology.org/formats/oboInOwl#" xmlns:metadata="http://data.bioontology.org/metadata/">
  <owl:Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_82114">
    <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_37512"/>
    <skos:notation>CHEBI:82114</skos:notation>
    <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_82114"/>
    <metadata_def:mappingLoom>demephiono</metadata_def:mappingLoom>
    <rdfs:label>Demephion-O</rdfs:label>
    <metadata_def:prefLabel>Demephion-O</metadata_def:prefLabel>
    <oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi#2_STAR"/>
    <oboinowl_gen:hasDbXref>PPDB:2756</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasDbXref>CAS:682-80-4</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasDbXref>KEGG:C18975</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace>
    <metadata:treeView rdf:resource="http://purl.obolibrary.org/obo/CHEBI_37512"/>
    <oboinowl_gen:id>CHEBI:82114</oboinowl_gen:id>
    <obo_purl:chebi/smiles>COP(=S)(OC)OCCSC</obo_purl:chebi/smiles>
    <obo_purl:chebi/formula>C5H13O3PS2</obo_purl:chebi/formula>
    <obo_purl:chebi/charge>0</obo_purl:chebi/charge>
    <obo_purl:chebi/mass>216.25900</obo_purl:chebi/mass>
    <obo_purl:chebi/inchikey>IATBEFPCSHFQJS-UHFFFAOYSA-N</obo_purl:chebi/inchikey>
    <obo_purl:chebi/monoisotopicmass>216.00437</obo_purl:chebi/monoisotopicmass>
    <obo_purl:chebi/inchi>InChI=1S/C5H13O3PS2/c1-6-9(10,7-2)8-4-5-11-3/h4-5H2,1-3H3</obo_purl:chebi/inchi>
  </owl:Class>
  <rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_82114">
    <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_82114"/>
  </rdf:Description>
</rdf:RDF>