CHEBI:73370 - iodocyanopindolol

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ChEBI Name iodocyanopindolol
ChEBI ID CHEBI:73370
Definition An indole that is 1H-indole substituted at positions 2, 3 and 7 by cyano, iodo and 3-(tert-butylamino)-2-hydroxypropoxy groups respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Margaret Duesbury
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Formula C16H20IN3O2
Net Charge 0
Average Mass 413.25340
Monoisotopic Mass 413.060
InChI InChI=1S/C16H20IN3O2/c1-16(2,3)19-8-10(21)9-22-13-6-4-5-11-14(13)15(17)12(7-18)20-11/h4-6,10,19-21H,8-9H2,1-3H3
InChIKey JBLUMBNIBNHRSO-UHFFFAOYSA-N
SMILES CC(C)(C)NCC(O)COc1cccc2[nH]c(C#N)c(I)c12
Roles Classification
Biological Role(s): beta-adrenergic antagonist
An agent that binds to but does not activate beta-adrenergic receptors thereby blocking the actions of endogenous or exogenous beta-adrenergic agonists. beta-Adrenergic antagonists are used for treatment of hypertension, cardiac arrhythmias, angina pectoris, glaucoma, migraine headaches and anxiety.
serotonergic antagonist
Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
Application(s): beta-adrenergic antagonist
An agent that binds to but does not activate beta-adrenergic receptors thereby blocking the actions of endogenous or exogenous beta-adrenergic agonists. beta-Adrenergic antagonists are used for treatment of hypertension, cardiac arrhythmias, angina pectoris, glaucoma, migraine headaches and anxiety.
serotonergic antagonist
Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
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ChEBI Ontology
Outgoing iodocyanopindolol (CHEBI:73370) has role β-adrenergic antagonist (CHEBI:35530)
iodocyanopindolol (CHEBI:73370) has role serotonergic antagonist (CHEBI:48279)
iodocyanopindolol (CHEBI:73370) is a aromatic ether (CHEBI:35618)
iodocyanopindolol (CHEBI:73370) is a indoles (CHEBI:24828)
iodocyanopindolol (CHEBI:73370) is a nitrile (CHEBI:18379)
iodocyanopindolol (CHEBI:73370) is a organoiodine compound (CHEBI:37142)
iodocyanopindolol (CHEBI:73370) is a secondary alcohol (CHEBI:35681)
iodocyanopindolol (CHEBI:73370) is a secondary amino compound (CHEBI:50995)
IUPAC Name
4-[3-(tert-butylamino)-2-hydroxypropoxy]-3-iodo-1-indole-2-carbonitrile
Synonym Source
4-(2-Hydroxy-3-(tert-butylamino)propoxy)-3-iodo-1H-indole-2-carbonitrile ChemIDplus
Database Link Database
Iodocyanopindolol Wikipedia
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Registry Numbers Types Sources
80180-26-3 CAS Registry Number ChemIDplus
8716017 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
20601048 PubMed citation Europe PMC
21734891 PubMed citation Europe PMC
23597562 PubMed citation Europe PMC
Last Modified
03 May 2013