U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry MIXED
Molecular Formula C18H29NO4
Molecular Weight 323.4272
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUFETOLOL

SMILES

CC(C)(C)NCC(O)COC1=C(OCC2CCCO2)C=CC=C1

InChI

InChIKey=AKLNLVOZXMQGSI-UHFFFAOYSA-N
InChI=1S/C18H29NO4/c1-18(2,3)19-11-14(20)12-22-16-8-4-5-9-17(16)23-13-15-7-6-10-21-15/h4-5,8-9,14-15,19-20H,6-7,10-13H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C18H29NO4
Molecular Weight 323.4272
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Description
Curator's Comment: Description was created based on several sources, including https://www.drugs.com/international/adobiol.html and https://www.jstage.jst.go.jp/article/circj/80/3/80_CJ-66-0122/_pdf

Bufetolol is a β-adrenergic blocking agent. Bufetolol hydrochloride (a derivative of Bufetolol) is reported as an ingredient of Adobiol in Japan. It is used for the treatment of hypertension and hypertrophic cardiomyopathy.

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
Primary
Adobiol

Approved Use

Indications: cardiovascular disorders
Primary
Adobiol

Approved Use

For the treatment of Hypertrophic cardiomyopathy
T1/2

T1/2

ValueDoseCo-administeredAnalytePopulation
1.48 h
10 mg single, oral
dose: 10 mg
route of administration: Oral
experiment type: SINGLE
co-administered:
BUFETOLOL blood
Homo sapiens
population: UNKNOWN
age: ADULT
sex: FEMALE / MALE
food status: UNKNOWN
PubMed

PubMed

TitleDatePubMed
Effects of beta-adrenoceptor blocking agents of N-tertiary butyl derivatives on maximum upstroke velocity of action potential in guinea-pig papillary muscles.
1983-09
Possible significance of the pharmacological differentiation of beta-blocking agents in hemodynamic effects in essential hypertension.
1983-03
Patents

Sample Use Guides

Daily dose approved in Japan for the treatment of hypertrophic cardiomyopathy - 15mg/day
Route of Administration: Oral
In Vitro Use Guide
Bufetolol (10(-4) M) additionally prolonged the time for 90% repolarization of the dog Purkinje fibres.
Substance Class Chemical
Created
by admin
on Mon Mar 31 18:25:51 GMT 2025
Edited
by admin
on Mon Mar 31 18:25:51 GMT 2025
Record UNII
WS1467RT9Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BUFETOLOL
INN   MI   WHO-DD  
INN  
Official Name English
Y 6124 FREE BASE
Preferred Name English
Y-6124 FREE BASE
Code English
1-(TERT-BUTYLAMINO)-3-(O-((TETRAHYDROFURFURYL)OXY)PHENOXY)-2-PROPANOL
Common Name English
BUFETOLOL [MI]
Common Name English
Bufetolol [WHO-DD]
Common Name English
bufetolol [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29576
Created by admin on Mon Mar 31 18:25:51 GMT 2025 , Edited by admin on Mon Mar 31 18:25:51 GMT 2025
Code System Code Type Description
DRUG CENTRAL
3046
Created by admin on Mon Mar 31 18:25:51 GMT 2025 , Edited by admin on Mon Mar 31 18:25:51 GMT 2025
PRIMARY
FDA UNII
WS1467RT9Z
Created by admin on Mon Mar 31 18:25:51 GMT 2025 , Edited by admin on Mon Mar 31 18:25:51 GMT 2025
PRIMARY
WIKIPEDIA
Bufetolol
Created by admin on Mon Mar 31 18:25:51 GMT 2025 , Edited by admin on Mon Mar 31 18:25:51 GMT 2025
PRIMARY
INN
3412
Created by admin on Mon Mar 31 18:25:51 GMT 2025 , Edited by admin on Mon Mar 31 18:25:51 GMT 2025
PRIMARY
MERCK INDEX
m1045
Created by admin on Mon Mar 31 18:25:51 GMT 2025 , Edited by admin on Mon Mar 31 18:25:51 GMT 2025
PRIMARY Merck Index
NCI_THESAURUS
C72612
Created by admin on Mon Mar 31 18:25:51 GMT 2025 , Edited by admin on Mon Mar 31 18:25:51 GMT 2025
PRIMARY
SMS_ID
100000076885
Created by admin on Mon Mar 31 18:25:51 GMT 2025 , Edited by admin on Mon Mar 31 18:25:51 GMT 2025
PRIMARY
EVMPD
SUB13131MIG
Created by admin on Mon Mar 31 18:25:51 GMT 2025 , Edited by admin on Mon Mar 31 18:25:51 GMT 2025
PRIMARY
EPA CompTox
DTXSID9057763
Created by admin on Mon Mar 31 18:25:51 GMT 2025 , Edited by admin on Mon Mar 31 18:25:51 GMT 2025
PRIMARY
CAS
53684-49-4
Created by admin on Mon Mar 31 18:25:51 GMT 2025 , Edited by admin on Mon Mar 31 18:25:51 GMT 2025
PRIMARY
MESH
C100228
Created by admin on Mon Mar 31 18:25:51 GMT 2025 , Edited by admin on Mon Mar 31 18:25:51 GMT 2025
PRIMARY
ChEMBL
CHEMBL347830
Created by admin on Mon Mar 31 18:25:51 GMT 2025 , Edited by admin on Mon Mar 31 18:25:51 GMT 2025
PRIMARY
PUBCHEM
2465
Created by admin on Mon Mar 31 18:25:51 GMT 2025 , Edited by admin on Mon Mar 31 18:25:51 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY