BUCUMOLOL

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C17H23NO4
Molecular Weight	305.3688
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BUCUMOLOL

Structure Search

SMILES

CC1=C2C=CC(=O)OC2=C(OCC(O)CNC(C)(C)C)C=C1

InChI

InChIKey=CIJVBYRUFLGDHY-UHFFFAOYSA-N

InChI=1S/C17H23NO4/c1-11-5-7-14(16-13(11)6-8-15(20)22-16)21-10-12(19)9-18-17(2,3)4/h5-8,12,18-19H,9-10H2,1-4H3

HIDE SMILES / InChI

Description
Sources: http://www.genome.jp/dbget-bin/www_bget?dr:D01492
Curator's Comment: Description was created based on several sources, including https://www.ncbi.nlm.nih.gov/pubmed/4148384

Bucumolol is a beta-adrenergic antagonist. It can be used in the treatment of myocardial ischemia and hypertension.

Originator

Approval Year

Targets

Targets

Primary Target	Pharmacology	Condition	Potency
Beta-1 adrenergic receptor 158 Target ID: CHEMBL213 Sources: http://www.genome.jp/dbget-bin/www_bget?dr:D01492	Antagonist 2778
Beta-2 adrenergic receptor 203 Target ID: CHEMBL210 Sources: http://www.genome.jp/dbget-bin/www_bget?dr:D01492	Antagonist 2778

Conditions

Conditions

Condition	Modality	Targets	Highest Phase	Product
Angina pectoris 106 Sources: http://www.ncbi.nlm.nih.gov/pubmed/24799	Primary		Preclinical	Unknown Approved Use Unknown
Hypertension 567 Sources: http://www.ncbi.nlm.nih.gov/pubmed/6117610	Primary		Basic research	Unknown Approved Use Unknown
Ventricular arrhythmia 50 Sources: http://www.ncbi.nlm.nih.gov/pubmed/44326	Primary		Basic research	Unknown Approved Use Unknown
Myocardial ischemia 15 Sources: http://www.ncbi.nlm.nih.gov/pubmed/6119377	Primary		Basic research	Unknown Approved Use Unknown

PubMed

PubMed

Title	Date	PubMed

Patents

Patents

Sample Use Guides

In Vivo Use Guide

Unknown

Route of Administration: Oral

In Vitro Use Guide

Unknown

Name

Type

Language

BUCUMOLOL

Official Name

English

BUCUMOLOL [MI]

Common Name

English

8-(3-(TERT-BUTYLAMINO)-2-HYDROXYPROPOXY)-5-METHYLCOUMARIN

Systematic Name

English

bucumolol [INN]

Common Name

English

Bucumolol [WHO-DD]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C29576

Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023

Code System Code Type Description

FDA UNII

U8WVJ3501L

Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023

PRIMARY

MERCK INDEX

m1042

Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023

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Merck Index

MESH

C024221

Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023

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PUBCHEM

169787

Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023

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DRUG CENTRAL

418

Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023

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SMS_ID

100000088453

Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023

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CAS

58409-59-9

Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023

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EPA CompTox

DTXSID00866688

Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023

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CAS

80750-21-6

Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023

SUPERSEDED

NCI_THESAURUS

C72611

Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023

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INN

3991

Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023

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WIKIPEDIA

Bucumolol

Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023

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EVMPD

SUB05954MIG

Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023

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ChEMBL

CHEMBL349807

Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023

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ACTIVE MOIETY


					U8WVJ3501L

BUCUMOLOL

SALT/SOLVATE (PARENT)


					U2Z7867QU7

BUCUMOLOL HYDROCHLORIDE