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Details

Stereochemistry RACEMIC
Molecular Formula C20H31NO5
Molecular Weight 365.4638
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IBUTEROL

SMILES

CC(C)C(=O)OC1=CC(=CC(OC(=O)C(C)C)=C1)C(O)CNC(C)(C)C

InChI

InChIKey=WKHOPHIMYDJVSA-UHFFFAOYSA-N
InChI=1S/C20H31NO5/c1-12(2)18(23)25-15-8-14(17(22)11-21-20(5,6)7)9-16(10-15)26-19(24)13(3)4/h8-10,12-13,17,21-22H,11H2,1-7H3

HIDE SMILES / InChI

Molecular Formula C20H31NO5
Molecular Weight 365.4638
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Ibuterol, a prodrug that is rapidly hydrolyzed to form a drug, terbutaline. Terbutaline, a beta-2 adrenergic agent used to treat asthma.

Approval Year

PubMed

PubMed

TitleDatePubMed
Comparison between ibuterol hydrochloride and terbutaline in asthma.
1976 Jan 10
Circulatory effects of oral and subcutaneous administration in normal subjects of a new bronchodilator, ibuterol, a pro-drug to terbutaline.
1976 Sep
Asthma: ibuterol versus terbutaline inhalation.
1977 Apr 16
Effects of ibuterol, a beta-2 adrenergic prodrug, on intraocular pressure.
1986 Summer

Sample Use Guides

In Vivo Use Guide
ibuterol, 0.75 mg
Route of Administration: Respiratory
Substance Class Chemical
Created
by admin
on Sat Dec 16 15:57:29 GMT 2023
Edited
by admin
on Sat Dec 16 15:57:29 GMT 2023
Record UNII
7V12DUP1CE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IBUTEROL
INN  
INN  
Official Name English
5-(2-(TERT-BUTYLAMINO)-1-HYDROXYETHYL)-M-PHENYLENE DIISOBUTYRATE
Systematic Name English
ibuterol [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C48149
Created by admin on Sat Dec 16 15:57:29 GMT 2023 , Edited by admin on Sat Dec 16 15:57:29 GMT 2023
Code System Code Type Description
ECHA (EC/EINECS)
258-311-4
Created by admin on Sat Dec 16 15:57:29 GMT 2023 , Edited by admin on Sat Dec 16 15:57:29 GMT 2023
PRIMARY
INN
3592
Created by admin on Sat Dec 16 15:57:29 GMT 2023 , Edited by admin on Sat Dec 16 15:57:29 GMT 2023
PRIMARY
EVMPD
SUB08101MIG
Created by admin on Sat Dec 16 15:57:29 GMT 2023 , Edited by admin on Sat Dec 16 15:57:29 GMT 2023
PRIMARY
CAS
53034-85-8
Created by admin on Sat Dec 16 15:57:29 GMT 2023 , Edited by admin on Sat Dec 16 15:57:29 GMT 2023
PRIMARY
PUBCHEM
68698
Created by admin on Sat Dec 16 15:57:29 GMT 2023 , Edited by admin on Sat Dec 16 15:57:29 GMT 2023
PRIMARY
FDA UNII
7V12DUP1CE
Created by admin on Sat Dec 16 15:57:29 GMT 2023 , Edited by admin on Sat Dec 16 15:57:29 GMT 2023
PRIMARY
NCI_THESAURUS
C83775
Created by admin on Sat Dec 16 15:57:29 GMT 2023 , Edited by admin on Sat Dec 16 15:57:29 GMT 2023
PRIMARY
MESH
C011287
Created by admin on Sat Dec 16 15:57:29 GMT 2023 , Edited by admin on Sat Dec 16 15:57:29 GMT 2023
PRIMARY
EPA CompTox
DTXSID70866296
Created by admin on Sat Dec 16 15:57:29 GMT 2023 , Edited by admin on Sat Dec 16 15:57:29 GMT 2023
PRIMARY
SMS_ID
100000083669
Created by admin on Sat Dec 16 15:57:29 GMT 2023 , Edited by admin on Sat Dec 16 15:57:29 GMT 2023
PRIMARY
ChEMBL
CHEMBL2104339
Created by admin on Sat Dec 16 15:57:29 GMT 2023 , Edited by admin on Sat Dec 16 15:57:29 GMT 2023
PRIMARY
Related Record Type Details
METABOLITE ACTIVE -> PRODRUG