{"@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/"},"@graph":[{"@id":"obo_purl:CHEBI_168396","@type":"owl:Class","rdfs:subClassOf":[{"@id":"obo_purl:CHEBI_25384"},{"@id":"obo_purl:CHEBI_33853"},{"@id":"obo_purl:CHEBI_37581"},{"@id":"obo_purl:CHEBI_38831"}],"rdfs:label":"mycophenolic acid","skos:notation":"CHEBI:168396","obo_purl:IAO_0000115":"A member of the class of 2-benzofurans that is 2-benzofuran-1(3H)-one which is substituted at positions 4, 5, 6, and 7 by methyl, methoxy, (2E)-5-carboxy-3-methylpent-2-en-1-yl, and hydroxy groups, respectively. It is an antibiotic produced by Penicillium brevi-compactum, P. stoloniferum, P. echinulatum and related species. An immunosuppressant, it is widely used (partiularly as its sodium salt and as the 2-(morpholin-4-yl)ethyl ester prodrug, mycophenolate mofetil) to prevent tissue rejection following organ transplants and for the treatment of certain autoimmune diseases.","oboinowl_gen:hasExactSynonym":"(4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoic acid","oboinowl_gen:hasDbXref":["Beilstein:318158","CAS:24280-93-1","DrugBank:DB01024","Drug_Central:1860","KEGG:D05096","PDBeChem:MOA","PMID:11272311","PMID:15470161","PMID:16629948","PMID:16640327","PMID:17482154","PMID:17498396","PMID:18194117","PMID:18611107","PMID:18996104","PMID:19689217","Patent:US4753935","Reaxys:318158","Wikipedia:Mycophenolic_acid"],"oboinowl_gen:hasOBONamespace":"chebi_ontology","oboinowl_gen:id":"CHEBI:168396","oboinowl_gen:inSubset":{"@id":"ns0:3_STAR"},"metadata_def:prefLabel":"mycophenolic acid","oboinowl_gen:hasRelatedSynonym":["Micofenolico acido","Mycophenolate","Mycophenolsaeure","(E)-6-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4-methyl-4-hexenoic acid","acide mycophenolique","acido micofenolico","acidum mycophenolicum","mycophenolic acid"],"metadata_def:mappingLoom":"mycophenolicacid","metadata_def:mappingSameURI":{"@id":"obo_purl:CHEBI_168396"},"oboinowl_gen:hasAlternativeId":"CHEBI:43973","obo_purl:RO_0000087":[{"@id":"obo_purl:CHEBI_25442"},{"@id":"obo_purl:CHEBI_35610"},{"@id":"obo_purl:CHEBI_35703"},{"@id":"obo_purl:CHEBI_35705"},{"@id":"obo_purl:CHEBI_149553"},{"@id":"obo_purl:CHEBI_53746"},{"@id":"obo_purl:CHEBI_76964"},{"@id":"obo_purl:CHEBI_78298"}],"ns1:charge":"0","ns1:formula":"C17H20O6","ns1:inchi":"InChI=1S/C17H20O6/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3/h4,20H,5-8H2,1-3H3,(H,18,19)/b9-4+","ns1:inchikey":"HPNSFSBZBAHARI-RUDMXATFSA-N","ns1:mass":"320.33710","ns1:monoisotopicmass":"320.12599","ns1:smiles":"COc1c(C)c2COC(=O)c2c(O)c1C\\C=C(/C)CCC(O)=O","ns0:is_conjugate_acid_of":{"@id":"obo_purl:CHEBI_62932"},"ns0:has_functional_parent":{"@id":"obo_purl:CHEBI_38355"}},{"@id":"obo_purl:CHEBI_62932","ns0:is_conjugate_base_of":{"@id":"obo_purl:CHEBI_168396"}},{"@id":"obo_purl:ECTO_9000557","obo_purl:RO_0002309":{"@id":"obo_purl:CHEBI_168396"}}]}