The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016

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Preferred Name	bupivacaine
Synonyms	bupivacaina 1-Butyl-N-(2,6-dimethylphenyl)-2-piperidinecarboxamide 1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide bupivacaine 1-Butyl-2',6'-pipecoloxylidide DL-Bupivacaine C18H28N2O Bupivacaine bupivacainum Carbostesin (+-)-Bupivacaine dl-1-Butyl-2',6'-pipecoloxylidide
ID	http://purl.obolibrary.org/obo/CHEBI_3215
AHFScode	72:00.00
altId	CHEBI:250882
ATCCode	N01BB01 N01BB10
binds	http://purl.obolibrary.org/obo/dinto_2913 http://purl.obolibrary.org/obo/dinto_0970 http://purl.obolibrary.org/obo/dinto_2651 http://purl.obolibrary.org/obo/dinto_2993 http://purl.obolibrary.org/obo/dinto_0291 http://purl.obolibrary.org/obo/dinto_0901
CASRN	2180-92-9
DBBrand	marcaina marcaine hcl bupivan anekain sensorcaine sensorcaine-mpf marcaine carbostesin
DBname	bupivacaine
DBSynonym	bupivacaine hcl bupivacaine hcl kit bloqueina bupivacaina [inn-spanish] lac-43 (+-)-bupivacaine cbupivacaine bupivacainum [inn-latin] dur-843 dl-bupivacaine
Definition	A piperidinecarboxamide-based amide-type local anaesthetic (amide caine) in which N-butylpipecolic acid and 2,6-dimethylaniline are combined to form the amide bond.
has effect	http://purl.obolibrary.org/obo/OAE_0000388 http://purl.obolibrary.org/obo/OAE_0000879 http://purl.obolibrary.org/obo/OAE_0000604 http://purl.obolibrary.org/obo/OAE_0000377 http://purl.obolibrary.org/obo/OAE_0001045 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_0000617 http://purl.obolibrary.org/obo/OAE_0001509 http://purl.obolibrary.org/obo/OAE_0001489 http://purl.obolibrary.org/obo/OAE_0000373 http://purl.obolibrary.org/obo/OAE_0000418 http://purl.obolibrary.org/obo/OAE_0000412 http://purl.obolibrary.org/obo/OAE_0000205 http://purl.obolibrary.org/obo/OAE_0000317 http://purl.obolibrary.org/obo/OAE_0000660 http://purl.obolibrary.org/obo/OAE_0001370 http://purl.obolibrary.org/obo/OAE_0001436 http://purl.obolibrary.org/obo/OAE_0000333 http://purl.obolibrary.org/obo/OAE_0000677 http://purl.obolibrary.org/obo/OAE_0000365 http://purl.obolibrary.org/obo/OAE_0000600 http://purl.obolibrary.org/obo/OAE_0001538 http://purl.obolibrary.org/obo/OAE_0000403 http://purl.obolibrary.org/obo/OAE_0000539 http://purl.obolibrary.org/obo/OAE_0000103 http://purl.obolibrary.org/obo/OAE_0001168 http://purl.obolibrary.org/obo/OAE_0000632 http://purl.obolibrary.org/obo/OAE_0000601 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_0000084 http://purl.obolibrary.org/obo/OAE_0000400 http://purl.obolibrary.org/obo/OAE_0000645 http://purl.obolibrary.org/obo/OAE_0000584 http://purl.obolibrary.org/obo/OAE_0001135 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_0000469 http://purl.obolibrary.org/obo/OAE_0000355 http://purl.obolibrary.org/obo/OAE_0000438 http://purl.obolibrary.org/obo/OAE_0000166 http://purl.obolibrary.org/obo/OAE_0001742 http://purl.obolibrary.org/obo/OAE_0000606 http://purl.obolibrary.org/obo/OAE_0000401 http://purl.obolibrary.org/obo/OAE_0000898 http://purl.obolibrary.org/obo/OAE_0000306 http://purl.obolibrary.org/obo/OAE_0000602 http://purl.obolibrary.org/obo/OAE_0000362 http://purl.obolibrary.org/obo/OAE_0000394 http://purl.obolibrary.org/obo/OAE_0000890 http://purl.obolibrary.org/obo/OAE_0000534
has pharmacological target	http://purl.obolibrary.org/obo/dinto_2913
has role	http://purl.obolibrary.org/obo/CHEBI_36333
InChI	InChI=1S/C18H28N2O/c1-4-5-12-20-13-7-6-11-16(20)18(21)19-17-14(2)9-8-10-15(17)3/h8-10,16H,4-7,11-13H2,1-3H3,(H,19,21)
InChIKey	InChIKey=LEBVLXFERQHONN-UHFFFAOYSA-N
inhibits	http://purl.obolibrary.org/obo/dinto_2913
is metabolised by	http://purl.obolibrary.org/obo/dinto_2651 http://purl.obolibrary.org/obo/dinto_2993 http://purl.obolibrary.org/obo/dinto_0291 http://purl.obolibrary.org/obo/dinto_0901
is substrate of	http://purl.obolibrary.org/obo/dinto_2651 http://purl.obolibrary.org/obo/dinto_2993 http://purl.obolibrary.org/obo/dinto_0291 http://purl.obolibrary.org/obo/dinto_0901
label	bupivacaine
may interact with	http://purl.obolibrary.org/obo/CHEBI_681850
prefixIRI	obo2:CHEBI_3215
prefLabel	bupivacaine
related with	http://purl.obolibrary.org/obo/dinto_0970
SMILES	CCCCN1CCCCC1C(=O)Nc1c(C)cccc1C CCCCN1CCCCC1C(=O)NC1=C(C)C=CC=C1C
Synonym	bupivacaina 1-Butyl-N-(2,6-dimethylphenyl)-2-piperidinecarboxamide 1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide bupivacaine 1-Butyl-2',6'-pipecoloxylidide DL-Bupivacaine C18H28N2O Bupivacaine bupivacainum Carbostesin (+-)-Bupivacaine dl-1-Butyl-2',6'-pipecoloxylidide
xref	Wikipedia:Bupivacaine PubChem Substance:46506768 Wikipedia:http://en.wikipedia.org/wiki/Bupivacaine NIST Chemistry WebBook:2180-92-9 Guide To Pharmacology:2397 PubChem Compound:2474 RxList:http://www.rxlist.com/cgi/generic2/bupivacaine.htm CASRN:38396-39-3 Drugs Product Database (DPD):2165414 KEGG COMPOUND:C07529 CASRN:2180-92-9 ChemSpider:2380 Drugs.com:http://www.drugs.com/cdi/bupivacaine-solution.html Patent:US2955111 CiteXplore:9989796 IUPHAR:2397 DrugBank:DB00297 KEGG DRUG:D07552 PharmGKB:PA135057240 National Drug Code Directory:0409-1761-02 ChEBI:3215
subClassOf	http://purl.obolibrary.org/obo/dinto_000055

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Mapping To	Ontology	Source
http://purl.obolibrary.org/obo/CHEBI_3215	DRON	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3215	PDRO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3215	OBIB	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3215	BERO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3215	DDSS	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3215	BIOMODELS	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3215	CHEBI	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3215	NIFSTD	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3215	DRON	SAME_URI
http://purl.bioontology.org/ontology/VANDF/4019643	VANDF	LOOM
http://purl.obolibrary.org/obo/CHEBI_3215	DRON	LOOM
http://purl.obolibrary.org/obo/CHEBI_3215	PDRO	LOOM
http://purl.obolibrary.org/obo/CHEBI_3215	OBIB	LOOM
http://purl.obolibrary.org/obo/CHEBI_3215	BERO	LOOM
http://purl.obolibrary.org/obo/CHEBI_3215	DDSS	LOOM
http://purl.obolibrary.org/obo/CHEBI_3215	BIOMODELS	LOOM
http://purl.obolibrary.org/obo/CHEBI_3215	CHEBI	LOOM
http://purl.obolibrary.org/obo/CHEBI_3215	NIFSTD	LOOM
http://purl.obolibrary.org/obo/CHEBI_3215	DRON	LOOM
http://purl.jp/bio/4/id/200906095780125400	IOBC	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D002045	RH-MESH	LOOM
http://purl.bioontology.org/ontology/MESH/D002045	MESH	LOOM
http://www.phoc.org.cn/pmo/class/PMO_00015831	PMAPP-PMO	LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C62011	NCIT	LOOM
http://purl.bioontology.org/ontology/LNC/LP16053-8	LOINC	LOOM
http://purl.bioontology.org/ontology/NDDF/005054	NDDF	LOOM
https://go.drugbank.com/drugs/DB00297	MDM	LOOM
http://stirdf.jst.go.jp/id/200907050934828396	IOBC	LOOM
http://purl.bioontology.org/ontology/LNC/MTHU014869	LOINC	LOOM
http://purl.bioontology.org/ontology/ATC/N01BB01	ATC	LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000147736	NDFRT	LOOM
http://bmi.utah.edu/ontologies/peontology/C0006400	RAO	LOOM
http://www.co-ode.org/ontologies/galen#Bupivacaine	GALEN	LOOM
http://stirdf.jst.go.jp/id/200907065771326328	IOBC	LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#2225	OCHV	LOOM
http://purl.obolibrary.org/obo/NCIT_C62011	BERO	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D02.065.199.239	RH-MESH	LOOM
http://purl.jp/bio/4/id/200906090488039747	IOBC	LOOM
http://purl.bioontology.org/ontology/RXNORM/1815	RXNORM	LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0006400	OCHV	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D03.383.621.758.323	RH-MESH	LOOM
http://purl.bioontology.org/ontology/SNMI/C-6B010	SNMI	LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/387150008	SNOMEDCT	LOOM
http://www.drugbank.ca/drugs/DB00297	FTC	LOOM
http://purl.obolibrary.org/obo/MESH_D002045	BERO	LOOM
http://purl.bioontology.org/ontology/RCD/x01AB	RCD	LOOM
http://purl.obolibrary.org/obo/OMIT_0003394	OMIT	LOOM