<?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#"> <owl:Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_4791"> <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_23457"/> <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_39089"/> <skos:notation>CHEBI:4791</skos:notation> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_4791"/> <metadata_def:mappingLoom>endosulfan</metadata_def:mappingLoom> <metadata_def:prefLabel>endosulfan</metadata_def:prefLabel> <obo_purl:IAO_0000115>A cyclic sulfite ester that is 1,5,5a,6,9,9a-hexahydro-6,9-methano-2,4,3-benzodioxathiepine 3-oxide substituted by chloro groups at positions 6, 7, 8, 9, 10 and 10.</obo_purl:IAO_0000115> <oboinowl_gen:hasExactSynonym>6,7,8,9,10,10-hexachloro-1,5,5a,6,9,9a-hexahydro-6,9-methano-2,4,3-benzodioxathiepine 3-oxide</oboinowl_gen:hasExactSynonym> <oboinowl_gen:hasExactSynonym>Endosulfan</oboinowl_gen:hasExactSynonym> <oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace> <oboinowl_gen:hasDbXref>Reaxys:1262315</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>Patent:CN103074276</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>Beilstein:1262315</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>KEGG:C11090</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>PPDB:264</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>Patent:ZW5287</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>Wikipedia:Endosulfan</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>CAS:115-29-7</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>Patent:CN102601109</oboinowl_gen:hasDbXref> <rdfs:label>endosulfan</rdfs:label> <oboinowl_gen:id>CHEBI:4791</oboinowl_gen:id> <oboinowl_gen:hasRelatedSynonym>1,4,5,6,7,7-Hexachloro-5-norbornene-2,3-dimethanol cyclic sulfite</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>1,9,10,11,12,12-hexachloro-4,6-dioxa-5-thiatricyclo[7.2.1.0(2,8)]dodec-10-ene 5-oxide</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>alpha,beta-1,2,3,4,7,7-Hexachlorobicyclo(2.2.1)-2-heptene-5,6-bisoxymethylene sulfite</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>1,4,5,6,7,7-Hexachloro-8,9,10-trinorborn-5-en-2,3-ylenedimethyl sulphite</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>Benzoepin</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi#3_STAR"/> <obo_purl:RO_0000087 rdf:resource="http://purl.obolibrary.org/obo/CHEBI_38999"/> <obo_purl:RO_0000087 rdf:resource="http://purl.obolibrary.org/obo/CHEBI_22153"/> <obo_purl:RO_0000087 rdf:resource="http://purl.obolibrary.org/obo/CHEBI_77853"/> <obo_purl:RO_0000087 rdf:resource="http://purl.obolibrary.org/obo/CHEBI_33286"/> <obo_purl:chebi/smiles>ClC1=C(Cl)C2(Cl)C3COS(=O)OCC3C1(Cl)C2(Cl)Cl</obo_purl:chebi/smiles> <obo_purl:chebi/formula>C9H6Cl6O3S</obo_purl:chebi/formula> <obo_purl:chebi/charge>0</obo_purl:chebi/charge> <obo_purl:chebi/mass>406.92434</obo_purl:chebi/mass> <obo_purl:chebi/inchikey>RDYMFSUJUZBWLH-UHFFFAOYSA-N</obo_purl:chebi/inchikey> <obo_purl:chebi/monoisotopicmass>403.81688</obo_purl:chebi/monoisotopicmass> <obo_purl:chebi/inchi>InChI=1S/C9H6Cl6O3S/c10-5-6(11)8(13)4-2-18-19(16)17-1-3(4)7(5,12)9(8,14)15/h3-4H,1-2H2</obo_purl:chebi/inchi> </owl:Class> <rdf:Description rdf:about="http://purl.obolibrary.org/obo/ECTO_9000720"> <obo_purl:RO_0002309> <rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_4791"> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_4791"/> </rdf:Description> </obo_purl:RO_0002309> </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#">
  <owl:Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_4791">
    <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_23457"/>
    <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_39089"/>
    <skos:notation>CHEBI:4791</skos:notation>
    <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_4791"/>
    <metadata_def:mappingLoom>endosulfan</metadata_def:mappingLoom>
    <metadata_def:prefLabel>endosulfan</metadata_def:prefLabel>
    <obo_purl:IAO_0000115>A cyclic sulfite ester that is 1,5,5a,6,9,9a-hexahydro-6,9-methano-2,4,3-benzodioxathiepine 3-oxide substituted by chloro groups at positions 6, 7, 8, 9, 10 and 10.</obo_purl:IAO_0000115>
    <oboinowl_gen:hasExactSynonym>6,7,8,9,10,10-hexachloro-1,5,5a,6,9,9a-hexahydro-6,9-methano-2,4,3-benzodioxathiepine 3-oxide</oboinowl_gen:hasExactSynonym>
    <oboinowl_gen:hasExactSynonym>Endosulfan</oboinowl_gen:hasExactSynonym>
    <oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace>
    <oboinowl_gen:hasDbXref>Reaxys:1262315</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasDbXref>Patent:CN103074276</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasDbXref>Beilstein:1262315</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasDbXref>KEGG:C11090</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasDbXref>PPDB:264</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasDbXref>Patent:ZW5287</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasDbXref>Wikipedia:Endosulfan</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasDbXref>CAS:115-29-7</oboinowl_gen:hasDbXref>
    <oboinowl_gen:hasDbXref>Patent:CN102601109</oboinowl_gen:hasDbXref>
    <rdfs:label>endosulfan</rdfs:label>
    <oboinowl_gen:id>CHEBI:4791</oboinowl_gen:id>
    <oboinowl_gen:hasRelatedSynonym>1,4,5,6,7,7-Hexachloro-5-norbornene-2,3-dimethanol cyclic sulfite</oboinowl_gen:hasRelatedSynonym>
    <oboinowl_gen:hasRelatedSynonym>1,9,10,11,12,12-hexachloro-4,6-dioxa-5-thiatricyclo[7.2.1.0(2,8)]dodec-10-ene 5-oxide</oboinowl_gen:hasRelatedSynonym>
    <oboinowl_gen:hasRelatedSynonym>alpha,beta-1,2,3,4,7,7-Hexachlorobicyclo(2.2.1)-2-heptene-5,6-bisoxymethylene sulfite</oboinowl_gen:hasRelatedSynonym>
    <oboinowl_gen:hasRelatedSynonym>1,4,5,6,7,7-Hexachloro-8,9,10-trinorborn-5-en-2,3-ylenedimethyl sulphite</oboinowl_gen:hasRelatedSynonym>
    <oboinowl_gen:hasRelatedSynonym>Benzoepin</oboinowl_gen:hasRelatedSynonym>
    <oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi#3_STAR"/>
    <obo_purl:RO_0000087 rdf:resource="http://purl.obolibrary.org/obo/CHEBI_38999"/>
    <obo_purl:RO_0000087 rdf:resource="http://purl.obolibrary.org/obo/CHEBI_22153"/>
    <obo_purl:RO_0000087 rdf:resource="http://purl.obolibrary.org/obo/CHEBI_77853"/>
    <obo_purl:RO_0000087 rdf:resource="http://purl.obolibrary.org/obo/CHEBI_33286"/>
    <obo_purl:chebi/smiles>ClC1=C(Cl)C2(Cl)C3COS(=O)OCC3C1(Cl)C2(Cl)Cl</obo_purl:chebi/smiles>
    <obo_purl:chebi/formula>C9H6Cl6O3S</obo_purl:chebi/formula>
    <obo_purl:chebi/charge>0</obo_purl:chebi/charge>
    <obo_purl:chebi/mass>406.92434</obo_purl:chebi/mass>
    <obo_purl:chebi/inchikey>RDYMFSUJUZBWLH-UHFFFAOYSA-N</obo_purl:chebi/inchikey>
    <obo_purl:chebi/monoisotopicmass>403.81688</obo_purl:chebi/monoisotopicmass>
    <obo_purl:chebi/inchi>InChI=1S/C9H6Cl6O3S/c10-5-6(11)8(13)4-2-18-19(16)17-1-3(4)7(5,12)9(8,14)15/h3-4H,1-2H2</obo_purl:chebi/inchi>
  </owl:Class>
  <rdf:Description rdf:about="http://purl.obolibrary.org/obo/ECTO_9000720">
    <obo_purl:RO_0002309>
      <rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_4791">
        <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_4791"/>
      </rdf:Description>
    </obo_purl:RO_0002309>
  </rdf:Description>
</rdf:RDF>