The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016

Preferred Name	acebutolol
Synonyms	acetobutolol N-{3-acetyl-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}butanamide Acebutolol acebutololum 5'-butyramido-2'-(2-hydroxy-3-isopropylaminopropoxy)acetophenone 3'-acetyl-4'-(2-hydroxy-3-(isopropylamino)propoxy)butyranilide N-[3-acetyl-4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]phenyl]butanamide (+-)-acebutolol N-(3-acetyl-4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl)butanamide acebutolol N-(3-acetyl-4-{2-hydroxy-3-[(propan-2-yl)amino]propoxy}phenyl)butanamide C18H28N2O4
ID	http://purl.obolibrary.org/obo/CHEBI_2379
AHFScode	24:24.00
ATCCode	C07AB04
binds	http://purl.obolibrary.org/obo/dinto_1970 http://purl.obolibrary.org/obo/dinto_2993 http://purl.obolibrary.org/obo/dinto_2907 http://purl.obolibrary.org/obo/dinto_3504 http://purl.obolibrary.org/obo/dinto_1440
CASRN	37517-30-9
DBBrand	sectral neptal prent
DBname	acebutolol
DBSynonym	acetobutolol acebutolol hcl acebutololo acebutolol hydrochloride dl-acebutolol
Definition	An ether that is the 2-acetyl-4-(butanoylamino)phenyl ether of the primary hydroxy group of 3-(propan-2-ylamino)propane-1,2-diol.
has effect	http://purl.obolibrary.org/obo/OAE_0000388 http://purl.obolibrary.org/obo/OAE_0001297 http://purl.obolibrary.org/obo/OAE_0000453 http://purl.obolibrary.org/obo/OAE_0000377 http://purl.obolibrary.org/obo/OAE_0000902 http://purl.obolibrary.org/obo/OAE_0000318 http://purl.obolibrary.org/obo/OAE_0000391 http://purl.obolibrary.org/obo/OAE_0000218 http://purl.obolibrary.org/obo/OAE_0000376 http://purl.obolibrary.org/obo/OAE_0000492 http://purl.obolibrary.org/obo/OAE_0000406 http://purl.obolibrary.org/obo/OAE_0000561 http://purl.obolibrary.org/obo/OAE_0000825 http://purl.obolibrary.org/obo/OAE_0001509 http://purl.obolibrary.org/obo/OAE_0000921 http://purl.obolibrary.org/obo/OAE_0000512 http://purl.obolibrary.org/obo/OAE_0000415 http://purl.obolibrary.org/obo/OAE_0000373 http://purl.obolibrary.org/obo/OAE_0000021 http://purl.obolibrary.org/obo/OAE_0000317 http://purl.obolibrary.org/obo/OAE_0000677 http://purl.obolibrary.org/obo/OAE_0000600 http://purl.obolibrary.org/obo/OAE_0000310 http://purl.obolibrary.org/obo/OAE_0000050 http://purl.obolibrary.org/obo/OAE_0000770 http://purl.obolibrary.org/obo/OAE_0000601 http://purl.obolibrary.org/obo/OAE_0000375 http://purl.obolibrary.org/obo/OAE_0000300 http://purl.obolibrary.org/obo/OAE_0000551 http://purl.obolibrary.org/obo/OAE_0000455 http://purl.obolibrary.org/obo/OAE_0001515 http://purl.obolibrary.org/obo/OAE_0000268 http://purl.obolibrary.org/obo/OAE_0000400 http://purl.obolibrary.org/obo/OAE_0000086 http://purl.obolibrary.org/obo/OAE_0002206 http://purl.obolibrary.org/obo/OAE_0000414 http://purl.obolibrary.org/obo/OAE_0000607 http://purl.obolibrary.org/obo/OAE_0001164 http://purl.obolibrary.org/obo/OAE_0000034 http://purl.obolibrary.org/obo/OAE_0000460 http://purl.obolibrary.org/obo/OAE_0000866 http://purl.obolibrary.org/obo/OAE_0000401 http://purl.obolibrary.org/obo/OAE_0000780 http://purl.obolibrary.org/obo/OAE_0000343 http://purl.obolibrary.org/obo/OAE_0000536 http://purl.obolibrary.org/obo/OAE_0000647 http://purl.obolibrary.org/obo/OAE_0001336 http://purl.obolibrary.org/obo/OAE_0001356 http://purl.obolibrary.org/obo/OAE_0000385 http://purl.obolibrary.org/obo/OAE_0000185 http://purl.obolibrary.org/obo/OAE_0000602 http://purl.obolibrary.org/obo/OAE_0000487 http://purl.obolibrary.org/obo/OAE_0000779 http://purl.obolibrary.org/obo/OAE_0000396 http://purl.obolibrary.org/obo/OAE_0000390 http://purl.obolibrary.org/obo/OAE_0000347 http://purl.obolibrary.org/obo/OAE_0000362 http://purl.obolibrary.org/obo/OAE_0000470 http://purl.obolibrary.org/obo/OAE_0000374 http://purl.obolibrary.org/obo/OAE_0000881 http://purl.obolibrary.org/obo/OAE_0000313 http://purl.obolibrary.org/obo/OAE_0000500 http://purl.obolibrary.org/obo/OAE_0000480 http://purl.obolibrary.org/obo/OAE_0000402 http://purl.obolibrary.org/obo/OAE_0000350
has pharmacological target	http://purl.obolibrary.org/obo/dinto_2907
has role	http://purl.obolibrary.org/obo/CHEBI_38070 http://purl.obolibrary.org/obo/CHEBI_35524 http://purl.obolibrary.org/obo/CHEBI_35674 http://purl.obolibrary.org/obo/CHEBI_35530
InChI	InChI=1S/C18H28N2O4/c1-5-6-18(23)20-14-7-8-17(16(9-14)13(4)21)24-11-15(22)10-19-12(2)3/h7-9,12,15,19,22H,5-6,10-11H2,1-4H3,(H,20,23)
InChIKey	InChIKey=GOEMGAFJFRBGGG-UHFFFAOYSA-N
inhibits	http://purl.obolibrary.org/obo/dinto_1970 http://purl.obolibrary.org/obo/dinto_2993
is substrate of	http://purl.obolibrary.org/obo/dinto_1440
is transported by	http://purl.obolibrary.org/obo/dinto_1440
label	acebutolol
may interact with	http://purl.obolibrary.org/obo/dinto_DB01307 http://purl.obolibrary.org/obo/CHEBI_9948 http://purl.obolibrary.org/obo/dinto_DB00839 http://purl.obolibrary.org/obo/dinto_DB00912 http://purl.obolibrary.org/obo/CHEBI_28918 http://purl.obolibrary.org/obo/CHEBI_3650 http://purl.obolibrary.org/obo/CHEBI_5147 http://purl.obolibrary.org/obo/CHEBI_5441 http://purl.obolibrary.org/obo/dinto_DB01306 http://purl.obolibrary.org/obo/CHEBI_49662 http://purl.obolibrary.org/obo/CHEBI_8249 http://purl.obolibrary.org/obo/dinto_DB01064 http://purl.obolibrary.org/obo/CHEBI_149226 http://purl.obolibrary.org/obo/CHEBI_584020 http://purl.obolibrary.org/obo/dinto_DB01291 http://purl.obolibrary.org/obo/dinto_DB00047 http://purl.obolibrary.org/obo/dinto_DB01289 http://purl.obolibrary.org/obo/CHEBI_5855 http://purl.obolibrary.org/obo/CHEBI_9449 http://purl.obolibrary.org/obo/CHEBI_9445 http://purl.obolibrary.org/obo/dinto_DB01067 http://purl.obolibrary.org/obo/dinto_DB00414 http://purl.obolibrary.org/obo/CHEBI_9011 http://purl.obolibrary.org/obo/CHEBI_50861 http://purl.obolibrary.org/obo/dinto_DB00236 http://purl.obolibrary.org/obo/dinto_DB00046 http://purl.obolibrary.org/obo/CHEBI_4822 http://purl.obolibrary.org/obo/CHEBI_4657 http://purl.obolibrary.org/obo/CHEBI_46631 http://purl.obolibrary.org/obo/dinto_DB01287 http://purl.obolibrary.org/obo/CHEBI_6456 http://purl.obolibrary.org/obo/CHEBI_68575 http://purl.obolibrary.org/obo/CHEBI_27999 http://purl.obolibrary.org/obo/CHEBI_8364 http://purl.obolibrary.org/obo/dinto_DB00816 http://purl.obolibrary.org/obo/CHEBI_64318 http://purl.obolibrary.org/obo/CHEBI_31654 http://purl.obolibrary.org/obo/CHEBI_4562 http://purl.obolibrary.org/obo/dinto_DB01309
prefixIRI	obo2:CHEBI_2379
prefLabel	acebutolol
related with	http://purl.obolibrary.org/obo/dinto_2907 http://purl.obolibrary.org/obo/dinto_3504
SMILES	CCCC(=O)Nc1ccc(OCC(O)CNC(C)C)c(c1)C(C)=O CCCC(=O)NC1=CC(C(C)=O)=C(OCC(O)CNC(C)C)C=C1
Synonym	acetobutolol N-{3-acetyl-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}butanamide Acebutolol acebutololum 5'-butyramido-2'-(2-hydroxy-3-isopropylaminopropoxy)acetophenone 3'-acetyl-4'-(2-hydroxy-3-(isopropylamino)propoxy)butyranilide N-[3-acetyl-4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]phenyl]butanamide (+-)-acebutolol N-(3-acetyl-4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl)butanamide acebutolol N-(3-acetyl-4-{2-hydroxy-3-[(propan-2-yl)amino]propoxy}phenyl)butanamide C18H28N2O4
xref	KEGG COMPOUND:C06803 PDRhealth:http://www.pdrhealth.com/drug_info/rxdrugprofiles/drugs/sec1396.shtml ChEMBL:127347 CASRN:2162244 CASRN:37517-30-9 ChemSpider:1901 Drugs Product Database (DPD):2257599 CiteXplore:1378852 PharmGKB:PA448011 BindingDB:25755 Patent:ZA6808345 NIST Chemistry WebBook:37517-30-9 ChEBI:2379 PubChem Substance:46509113 Wikipedia:Acebutolol National Drug Code Directory:0378-1200-01 PubChem Compound:1978 RxList:http://www.rxlist.com/cgi/generic2/ace.htm KEGG DRUG:D02338 DrugBank:DB01193 Drugs.com:http://www.drugs.com/cdi/acebutolol.html Gmelin:2179873 Wikipedia:http://en.wikipedia.org/wiki/Acebutolol Patent:US3857952
subClassOf	http://purl.obolibrary.org/obo/dinto_000055

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Mapping To	Ontology	Source
http://purl.obolibrary.org/obo/CHEBI_2379	DRON	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_2379	PDRO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_2379	CHEBI	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_2379	BERO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_2379	DDSS	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_2379	BIOMODELS	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_2379	NIFSTD	SAME_URI
http://purl.jp/bio/4/id/200906018137742392	IOBC	LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000147688	NDFRT	LOOM
http://purl.bioontology.org/ontology/SNMI/C-80340	SNMI	LOOM
http://purl.bioontology.org/ontology/LNC/MTHU007114	LOINC	LOOM
http://purl.bioontology.org/ontology/MESH/D000070	MESH	LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0000946	OCHV	LOOM
http://purl.bioontology.org/ontology/ATC/C07AB04	ATC	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D02.092.063.624.698.025	RH-MESH	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D02.033.755.624.698.025	RH-MESH	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D02.033.100.624.698.025	RH-MESH	LOOM
http://purl.obolibrary.org/obo/MESH_D000070	BERO	LOOM
http://purl.obolibrary.org/obo/NCIT_C61525	BERO	LOOM
http://purl.obolibrary.org/obo/OMIT_0001514	OMIT	LOOM
http://purl.bioontology.org/ontology/LNC/LP16015-7	LOINC	LOOM
http://purl.bioontology.org/ontology/RCD/bd2..	RCD	LOOM
https://go.drugbank.com/drugs/DB01193	MDM	LOOM
http://stirdf.jst.go.jp/id/200907009989231402	IOBC	LOOM
http://purl.bioontology.org/ontology/RXNORM/149	NLMVS	LOOM
http://purl.bioontology.org/ontology/RXNORM/149	RXNORM	LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/372815001	SNOMEDCT	LOOM
http://purl.obolibrary.org/obo/CHEBI_2379	DRON	LOOM
http://purl.obolibrary.org/obo/CHEBI_2379	PDRO	LOOM
http://purl.obolibrary.org/obo/CHEBI_2379	CHEBI	LOOM
http://purl.obolibrary.org/obo/CHEBI_2379	BERO	LOOM
http://purl.obolibrary.org/obo/CHEBI_2379	DDSS	LOOM
http://purl.obolibrary.org/obo/CHEBI_2379	BIOMODELS	LOOM
http://purl.obolibrary.org/obo/CHEBI_2379	NIFSTD	LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#594	OCHV	LOOM
http://purl.bioontology.org/ontology/VANDF/4019592	VANDF	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D000070	RH-MESH	LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C61525	NCIT	LOOM
http://www.drugbank.ca/drugs/DB01193	FTC	LOOM
http://www.phoc.org.cn/pmo/class/PMO_00015675	PMAPP-PMO	LOOM
http://www.co-ode.org/ontologies/galen#Acebutolol	GALEN	LOOM