{"@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_28527","@type":"owl:Class","rdfs:subClassOf":{"@id":"obo_purl:CHEBI_24698"},"rdfs:label":"rutin","skos:notation":"CHEBI:28527","obo_purl:IAO_0000115":"A rutinoside that is quercetin with the hydroxy group at position C-3 substituted with glucose and rhamnose sugar groups.","oboinowl_gen:hasExactSynonym":["Rutin","2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside"],"oboinowl_gen:hasDbXref":["Beilstein:75455","CAS:153-18-4","DrugBank:DB01698","Drug_Central:3535","HMDB:HMDB0003249","KEGG:C05625","KEGG:D00190","KEGG:D08499","KNApSAcK:C00005413","LINCS:LSM-2457","MetaCyc:RUTIN","PDBeChem:RUT","PMID:14979715","PMID:15601236","PMID:20701244","PMID:30307940","PMID:31382673","PMID:33917795","Reaxys:75455","Wikipedia:Rutin"],"oboinowl_gen:hasOBONamespace":"chebi_ontology","oboinowl_gen:id":"CHEBI:28527","oboinowl_gen:inSubset":{"@id":"ns0:3_STAR"},"metadata_def:prefLabel":"rutin","oboinowl_gen:hasRelatedSynonym":["3-Rhamnoglucosylquercetin","3-Rutinosyl quercetin","Phytomelin","Quercetin 3-rutinoside","Quercetin-3-rutinoside","Rutoside","3-[[6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one"],"metadata_def:mappingLoom":"rutin","metadata_def:mappingSameURI":{"@id":"obo_purl:CHEBI_28527"},"oboinowl_gen:hasAlternativeId":["CHEBI:26585","CHEBI:45398","CHEBI:8923"],"ns1:charge":"0","ns1:formula":"C27H30O16","ns1:inchi":"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1","ns1:inchikey":"IKGXIBQEEMLURG-NVPNHPEKSA-N","ns1:mass":"610.521","ns1:monoisotopicmass":"610.15338","ns1:smiles":"C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=C(OC4=C(C(O)=CC(O)=C4)C3=O)C3=CC=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O"}
{"@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_28527","@type":"owl:Class","rdfs:subClassOf":{"@id":"obo_purl:CHEBI_24698"},"rdfs:label":"rutin","skos:notation":"CHEBI:28527","obo_purl:IAO_0000115":"A rutinoside that is quercetin with the hydroxy group at position C-3 substituted with glucose and rhamnose sugar groups.","oboinowl_gen:hasExactSynonym":["Rutin","2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside"],"oboinowl_gen:hasDbXref":["Beilstein:75455","CAS:153-18-4","DrugBank:DB01698","Drug_Central:3535","HMDB:HMDB0003249","KEGG:C05625","KEGG:D00190","KEGG:D08499","KNApSAcK:C00005413","LINCS:LSM-2457","MetaCyc:RUTIN","PDBeChem:RUT","PMID:14979715","PMID:15601236","PMID:20701244","PMID:30307940","PMID:31382673","PMID:33917795","Reaxys:75455","Wikipedia:Rutin"],"oboinowl_gen:hasOBONamespace":"chebi_ontology","oboinowl_gen:id":"CHEBI:28527","oboinowl_gen:inSubset":{"@id":"ns0:3_STAR"},"metadata_def:prefLabel":"rutin","oboinowl_gen:hasRelatedSynonym":["3-Rhamnoglucosylquercetin","3-Rutinosyl quercetin","Phytomelin","Quercetin 3-rutinoside","Quercetin-3-rutinoside","Rutoside","3-[[6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one"],"metadata_def:mappingLoom":"rutin","metadata_def:mappingSameURI":{"@id":"obo_purl:CHEBI_28527"},"oboinowl_gen:hasAlternativeId":["CHEBI:26585","CHEBI:45398","CHEBI:8923"],"ns1:charge":"0","ns1:formula":"C27H30O16","ns1:inchi":"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1","ns1:inchikey":"IKGXIBQEEMLURG-NVPNHPEKSA-N","ns1:mass":"610.521","ns1:monoisotopicmass":"610.15338","ns1:smiles":"C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=C(OC4=C(C(O)=CC(O)=C4)C3=O)C3=CC=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O"}