<?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:ns1="http://purl.obolibrary.org/obo#" xmlns:ns2="http://www.ebi.ac.uk/efo/" xmlns:metadata_def="http://data.bioontology.org/metadata/def/"> <owl:Class rdf:about="http://purl.obolibrary.org/obo/CHEBI_50095"> <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_18059"/> <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_37622"/> <rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_36976"/> <rdfs:label>bucladesine</rdfs:label> <skos:notation>CHEBI:50095</skos:notation> <obo_purl:IAO_0000115>A 3',5'-cyclic purine nucleotide that is the 2'-butanoate ester and 6-N-butanoyl derivative of 3',5'-cyclic AMP.</obo_purl:IAO_0000115> <oboinowl_gen:hasExactSynonym>6-N-butanoyl-2'-O-butanoyladenosine 3',5'-(hydrogen phosphate)</oboinowl_gen:hasExactSynonym> <oboinowl_gen:hasExactSynonym>(4aR,6R,7R,7aR)-6-(6-butanamido-9H-purin-9-yl)-2-hydroxy-2-oxidotetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-yl butanoate</oboinowl_gen:hasExactSynonym> <oboinowl_gen:hasDbXref>CAS:362-74-3</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>Drug_Central:415</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>KEGG:D07546</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>LINCS:LSM-1926</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>NCIt:C83562</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>PMID:15231695</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>PMID:20353690</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>PMID:23335001</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>PMID:27022216</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>PMID:29963999</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>Reaxys:871714</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>Wikipedia:Bucladesine</oboinowl_gen:hasDbXref> <oboinowl_gen:hasDbXref>MESH:D003994</oboinowl_gen:hasDbXref> <oboinowl_gen:hasOBONamespace>chebi_ontology</oboinowl_gen:hasOBONamespace> <oboinowl_gen:id>CHEBI:50095</oboinowl_gen:id> <oboinowl_gen:inSubset rdf:resource="http://purl.obolibrary.org/obo/chebi#3_STAR"/> <ns1:has_role rdf:resource="http://www.ebi.ac.uk/efo/EFO_0001899"/> <metadata_def:prefLabel>bucladesine</metadata_def:prefLabel> <oboinowl_gen:hasRelatedSynonym>3',5'-cyclic AMP dibutyrate</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>Bt2cAMP</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>N(6),2'-O-dibutyryl cAMP</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>N(6),2'-O-dibutyryl cyclic AMP</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>N(6),O(2')-dibutyryl cAMP</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>N(6),O(2')-dibutyryl cyclic 3',5'-AMP</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>N(6),O(2')-dibutyryl cyclic AMP</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>N(6),O(2')-dibutyryl-3',5'-cyclic AMP</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>N(6),O(2')-dibutyryladenosine 3',5'-monophosphate</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>bucladesina</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>bucladesine</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>bucladesinum</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>dbcAMP</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>dibutyryl 3',5'-cyclic AMP</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>dibutyryl adenosine 3',5'-cyclic phosphate</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>dibutyryl adenosine 3',5'-monophosphate</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>dibutyryl cAMP</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>dibutyryl cyclic 3',5'-adenylic acid</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>dibutyryl cyclic AMP</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>dibutyryl cyclic adenosine 3',5'-monophosphate</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>dibutyryl-3',5'-AMP</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>dibutyryladenosine 3',5'-cyclic monophosphate</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>dibutyryladenosine cyclic monophosphate</oboinowl_gen:hasRelatedSynonym> <oboinowl_gen:hasRelatedSynonym>N(6),O(2')-dibutyryl adenosine 3',5'-cyclic monophosphate</oboinowl_gen:hasRelatedSynonym> <metadata_def:mappingLoom>bucladesine</metadata_def:mappingLoom> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_50095"/> <oboinowl_gen:hasAlternativeId>CHEBI:143000</oboinowl_gen:hasAlternativeId> <obo_purl:chebi/charge>0</obo_purl:chebi/charge> <obo_purl:chebi/formula>C18H24N5O8P</obo_purl:chebi/formula> <obo_purl:chebi/inchi>InChI=1S/C18H24N5O8P/c1-3-5-11(24)22-16-13-17(20-8-19-16)23(9-21-13)18-15(30-12(25)6-4-2)14-10(29-18)7-28-32(26,27)31-14/h8-10,14-15,18H,3-7H2,1-2H3,(H,26,27)(H,19,20,22,24)/t10-,14-,15-,18-/m1/s1</obo_purl:chebi/inchi> <obo_purl:chebi/inchikey>CJGYSWNGNKCJSB-YVLZZHOMSA-N</obo_purl:chebi/inchikey> <obo_purl:chebi/mass>469.391</obo_purl:chebi/mass> <obo_purl:chebi/monoisotopicmass>469.13625</obo_purl:chebi/monoisotopicmass> <obo_purl:chebi/smiles>[C@H]12O[C@H]([C@@H]([C@@H]1OP(OC2)(=O)O)OC(=O)CCC)N3C=NC=4C(=NC=NC34)NC(=O)CCC</obo_purl:chebi/smiles> </owl:Class> <rdf:Description rdf:about="http://purl.obolibrary.org/obo/CHEBI_50095"> <metadata_def:mappingSameURI rdf:resource="http://purl.obolibrary.org/obo/CHEBI_50095"/> </rdf:Description> </rdf:RDF>