<?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_31018"> <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_23053"/> <rdfs:label>(+)-gallocatechin</rdfs:label> <rdfs:label rdf:datatype="http://www.w3.org/XML/1998/namespacestring">(+)-gallocatechin</rdfs:label> <skos:notation>CHEBI:31018</skos:notation> <obo_purl:IAO_0000115>A gallocatechin that has (2R,3S)-configuration. It is found in green tea and bananas.</obo_purl:IAO_0000115> <oboinowl_gen:hasExactSynonym>(2R,3S)-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol</oboinowl_gen:hasExactSynonym> <oboinowl_gen:hasDbXref>CAS:970-73-0</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>Chemspider:58594</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>KEGG:C12127</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>KNApSAcK:C00008817</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>PMID:22430120</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>PMID:9741297</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>Reaxys:94058</oboinowl_gen:hasDbXref> <oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace> <oboinowl_gen:id>CHEBI:31018</oboinowl_gen:id> <oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi#3_STAR"/> <metadata_def:prefLabel>(+)-gallocatechin</metadata_def:prefLabel> <oboinowl_gen:hasRelatedSynonym>(+)-gallocatechol</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>(2R,3S)-(+)-gallocatechin</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>(2R,3S)-flavan-3,3',4',5,5',7-hexol</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>(2R,3S)-flavan-3,5,7,3',4',5'-hexol</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>(2R,3S)-gallocatechin</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>gallocatechin</oboinowl_gen:hasRelatedSynonym> <metadata_def:mappingLoom>gallocatechin</metadata_def:mappingLoom> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_31018"/> <obo_purl:chebi/charge>0</obo_purl:chebi/charge> <obo_purl:chebi/formula>C15H14O7</obo_purl:chebi/formula> <obo_purl:chebi/inchi>InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15+/m0/s1</obo_purl:chebi/inchi> <obo_purl:chebi/inchikey>XMOCLSLCDHWDHP-SWLSCSKDSA-N</obo_purl:chebi/inchikey> <obo_purl:chebi/mass>306.26750</obo_purl:chebi/mass> <obo_purl:chebi/monoisotopicmass>306.07395</obo_purl:chebi/monoisotopicmass> <obo_purl:chebi/smiles>O[C@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1cc(O)c(O)c(O)c1</obo_purl:chebi/smiles> </owl:Class> <rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_31018"> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_31018"/> </rdf:Description> </rdf:RDF>