{"@context":{"obo_purl":"http://purl.obolibrary.org/obo/","rdf":"http://www.w3.org/1999/02/22-rdf-syntax-ns#","owl":"http://www.w3.org/2002/07/owl#","rdfs":"http://www.w3.org/2000/01/rdf-schema#","skos":"http://www.w3.org/2004/02/skos/core#","oboinowl_gen":"http://www.geneontology.org/formats/oboInOwl#","ns0":"http://purl.obolibrary.org/obo/chebi#","metadata_def":"http://data.bioontology.org/metadata/def/","ns1":"http://purl.obolibrary.org/obo/chebi/"},"@id":"obo_purl:CHEBI_31018","@type":"owl:Class","rdfs:subClassOf":{"@id":"obo_purl:CHEBI_23053"},"rdfs:label":["(+)-gallocatechin",{"@type":"http://www.w3.org/XML/1998/namespacestring","@value":"(+)-gallocatechin"}],"skos:notation":"CHEBI:31018","obo_purl:IAO_0000115":"A gallocatechin that has (2R,3S)-configuration. It is found in green tea and bananas.","oboinowl_gen:hasExactSynonym":"(2R,3S)-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol","oboinowl_gen:hasDbXref":["CAS:970-73-0","Chemspider:58594","KEGG:C12127","KNApSAcK:C00008817","PMID:22430120","PMID:9741297","Reaxys:94058"],"oboinowl_gen:hasOBONamespace":"chebi_ontology","oboinowl_gen:id":"CHEBI:31018","oboinowl_gen:inSubset":{"@id":"ns0:3_STAR"},"metadata_def:prefLabel":"(+)-gallocatechin","oboinowl_gen:hasRelatedSynonym":["(+)-gallocatechol","(2R,3S)-(+)-gallocatechin","(2R,3S)-flavan-3,3',4',5,5',7-hexol","(2R,3S)-flavan-3,5,7,3',4',5'-hexol","(2R,3S)-gallocatechin","gallocatechin"],"metadata_def:mappingLoom":"gallocatechin","metadata_def:mappingSameURI":{"@id":"obo_purl:CHEBI_31018"},"ns1:charge":"0","ns1:formula":"C15H14O7","ns1: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","ns1:inchikey":"XMOCLSLCDHWDHP-SWLSCSKDSA-N","ns1:mass":"306.26750","ns1:monoisotopicmass":"306.07395","ns1:smiles":"O[C@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1cc(O)c(O)c(O)c1"}