COVID-19 Ontology

Last uploaded: February 25, 2021
Preferred Name

labetalol
Synonyms

3-Carboxamido-4-hydroxy-alpha-((1-methyl-3-phenylpropylamino)methyl)benzyl alcohol

5-(1-Hydroxy-2-(1-methyl-3-phenylpropylamino)ethyl)salicylamide

labetalolum

kabetalol

labetalol

2-hydroxy-5-{1-hydroxy-2-[(1-methyl-3-phenylpropyl)amino]ethyl}benzamide

Labetalol

Definitions

A secondary amino compound formally derived from ammonia by replacing two of the hydrogens by 2-(3-carbamoyl-4-hydroxyphenyl)-2-hydroxyethyl and 4-phenylbutan-2-yl groups. It is an adrenergic antagonist used to treat high blood pressure.

ID

http://purl.obolibrary.org/obo/CHEBI_6343

alternative_term

2-hydroxy-5-{1-hydroxy-2-[(1-methyl-3-phenylpropyl)amino]ethyl}benzamide

Labetalol

charge

0

database_cross_reference

Patent:DE2032642

LINCS:LSM-1282

KEGG:D08106

Reaxys:2948416

Drug_Central:1531

CAS:36894-69-6

Beilstein:2948416

PMID:21908132

PMID:22528277

Patent:US4012444

Wikipedia:Labetalol

KEGG:C07063

HMDB:HMDB0014736

PMID:28166217

PMID:23055089

PMID:22300487

DrugBank:DB00598

definition

A secondary amino compound formally derived from ammonia by replacing two of the hydrogens by 2-(3-carbamoyl-4-hydroxyphenyl)-2-hydroxyethyl and 4-phenylbutan-2-yl groups. It is an adrenergic antagonist used to treat high blood pressure.

formula

C19H24N2O3

fromArticle

true

has_obo_namespace

chebi_ontology

has_related_synonym

3-Carboxamido-4-hydroxy-alpha-((1-methyl-3-phenylpropylamino)methyl)benzyl alcohol

5-(1-Hydroxy-2-(1-methyl-3-phenylpropylamino)ethyl)salicylamide

labetalolum

kabetalol

labetalol

id

CHEBI:6343

imported from

http://purl.obolibrary.org/obo/chebi.owl

in_subset

http://purl.oboInOwllibrary.org/oboInOwl/chebi#3_STAR

inchi

InChI=1S/C19H24N2O3/c1-13(7-8-14-5-3-2-4-6-14)21-12-18(23)15-9-10-17(22)16(11-15)19(20)24/h2-6,9-11,13,18,21-23H,7-8,12H2,1H3,(H2,20,24)

inchikey

SGUAFYQXFOLMHL-UHFFFAOYSA-N

label

labetalol

mass

328.40554

monoisotopicmass

328.17869

notation

CHEBI:6343

preferred label

labetalol

prefLabel

labetalol

see also

https://onlinelibrary.wiley.com/doi/full/10.1002/jmv.25681

smiles

CC(CCc1ccccc1)NCC(O)c1ccc(O)c(c1)C(N)=O

textual definition

A secondary amino compound formally derived from ammonia by replacing two of the hydrogens by 2-(3-carbamoyl-4-hydroxyphenyl)-2-hydroxyethyl and 4-phenylbutan-2-yl groups. It is an adrenergic antagonist used to treat high blood pressure.

subClassOf

http://purl.obolibrary.org/obo/CHEBI_23888

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Delete Mapping To Ontology Source
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http://purl.obolibrary.org/obo/CHEBI_6343 CCONT SAME_URI
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http://purl.obolibrary.org/obo/CHEBI_6343 NIFSTD SAME_URI
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https://go.drugbank.com/drugs/DB00598 MDM LOOM
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http://purl.bioontology.org/ontology/ATC/C07AG01 ATC LOOM
http://purl.bioontology.org/ontology/RXNORM/6185 NLMVS LOOM
http://purl.bioontology.org/ontology/RXNORM/6185 RXNORM LOOM
http://purl.bioontology.org/ontology/LNC/LP16170-0 LOINC LOOM
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http://purl.obolibrary.org/obo/CHEBI_6343 DRON LOOM
http://purl.obolibrary.org/obo/CHEBI_6343 PDRO LOOM
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http://purl.obolibrary.org/obo/CHEBI_6343 DDSS LOOM
http://purl.obolibrary.org/obo/CHEBI_6343 TXPO LOOM
http://purl.obolibrary.org/obo/CHEBI_6343 BIOMODELS LOOM
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http://purl.obolibrary.org/obo/CHEBI_6343 NIFSTD LOOM
http://www.drugbank.ca/drugs/DB00598 FTC LOOM
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http://stirdf.jst.go.jp/id/200907005358862693 IOBC LOOM