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Details

Stereochemistry RACEMIC
Molecular Formula C12H18FNO.ClH
Molecular Weight 247.737
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FLEROBUTEROL HYDROCHLORIDE

SMILES

Cl.CC(C)(C)NCC(O)C1=C(F)C=CC=C1

InChI

InChIKey=NXNFXCMJTRKWFF-UHFFFAOYSA-N
InChI=1S/C12H18FNO.ClH/c1-12(2,3)14-8-11(15)9-6-4-5-7-10(9)13;/h4-7,11,14-15H,8H2,1-3H3;1H

HIDE SMILES / InChI

Molecular Formula C12H18FNO
Molecular Weight 211.2758
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

FLEROBUTEROL is a beta-adrenoceptor agonist with potential antidepressant activity.

CNS Activity

Curator's Comment: Known to be CNS active in rat. Human data not available.

Approval Year

PubMed

PubMed

TitleDatePubMed
Effects of CRL 40827 and salbutamol on exocrine pancreatic secretion in rats.
1988 Jan 27
Flerobuterol, a beta-adrenoceptor agonist, enhances serotonergic neurotransmission: an electrophysiological study in the rat brain.
1991
Flerobuterol: a potential antidepressant drug related to beta-adrenergic agonists. Experimental profile in mice.
1991
Evidence for different interactions between beta(1)- and beta(2)-adrenoceptor subtypes with adenylyl cyclase in the rat brain: a concentration-response study using forskolin.
2000 Apr
Patents

Patents

Sample Use Guides

In Vitro Use Guide
Flerobuterol is a beta1- and beta2-adrenoceptor agonist (Ki = 926 nM and 518 nM, respectively).
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:30:38 GMT 2023
Edited
by admin
on Sat Dec 16 08:30:38 GMT 2023
Record UNII
SC4AEV9EKY
Record Status Validated (UNII)
Record Version
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Name Type Language
FLEROBUTEROL HYDROCHLORIDE
Common Name English
BENZENEMETHANOL, .ALPHA.-(((1,1-DIMETHYLETHYL)AMINO)METHYL)-2-FLUORO-, HYDROCHLORIDE (1:1)
Systematic Name English
CRL-40827
Code English
BENZENEMETHANOL, .ALPHA.-(((1,1-DIMETHYLETHYL)AMINO)METHYL)-2-FLUORO-, HYDROCHLORIDE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID601002475
Created by admin on Sat Dec 16 08:30:39 GMT 2023 , Edited by admin on Sat Dec 16 08:30:39 GMT 2023
PRIMARY
FDA UNII
SC4AEV9EKY
Created by admin on Sat Dec 16 08:30:39 GMT 2023 , Edited by admin on Sat Dec 16 08:30:39 GMT 2023
PRIMARY
CAS
95918-64-2
Created by admin on Sat Dec 16 08:30:39 GMT 2023 , Edited by admin on Sat Dec 16 08:30:39 GMT 2023
SUPERSEDED
CAS
82101-08-4
Created by admin on Sat Dec 16 08:30:39 GMT 2023 , Edited by admin on Sat Dec 16 08:30:39 GMT 2023
PRIMARY
PUBCHEM
3067835
Created by admin on Sat Dec 16 08:30:39 GMT 2023 , Edited by admin on Sat Dec 16 08:30:39 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
PARENT -> SALT/SOLVATE
ENANTIOMER -> RACEMATE