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

Details

Stereochemistry RACEMIC
Molecular Formula C12H20N2O3.C2H4O2
Molecular Weight 300.3508
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PIRBUTEROL ACETATE

SMILES

CC(O)=O.CC(C)(C)NCC(O)C1=NC(CO)=C(O)C=C1

InChI

InChIKey=QSXMZJGGEWYVCN-UHFFFAOYSA-N
InChI=1S/C12H20N2O3.C2H4O2/c1-12(2,3)13-6-11(17)8-4-5-10(16)9(7-15)14-8;1-2(3)4/h4-5,11,13,15-17H,6-7H2,1-3H3;1H3,(H,3,4)

HIDE SMILES / InChI

Molecular Formula C12H20N2O3
Molecular Weight 240.2988
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Molecular Formula C2H4O2
Molecular Weight 60.052
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:25:35 UTC 2023
Edited
by admin
on Fri Dec 15 15:25:35 UTC 2023
Record UNII
1EH73XKR9N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PIRBUTEROL ACETATE
MART.   ORANGE BOOK   USAN   USP-RS   VANDF   WHO-DD  
USAN  
Official Name English
SPIROLAIR
Brand Name English
CP-24314-14
Code English
MAXAIR
Brand Name English
PIRBUTEROL ACETATE [USAN]
Common Name English
2,6-PYRIDINEDIMETHANOL, .ALPHA.6-(((1,1-DIMETHYLETHYL)AMINO)METHYL)-3-HYDROXY-, MONOACETATE (SALT)
Common Name English
PIRBUTEROL ACETATE [MART.]
Common Name English
2,6-PYRIDINEDIMETHANOL, .ALPHA.6-(((1,1-DIMETHYLETHYL)AMINO)METHYL)-3-HYDROXY-, ACETATE (1:1)
Common Name English
CP-24,314-14
Code English
PIRBUTEROL MONOACETATE
MI  
Common Name English
α6-[(tert-Butylamino)methyl]-3-hydroxy-2,6-pyridinedimethanol monoacetate (salt)
Common Name English
PIRBUTEROL MONOACETATE [MI]
Common Name English
PIRBUTEROL ACETATE [ORANGE BOOK]
Common Name English
PIRBUTEROL ACETATE [VANDF]
Common Name English
Pirbuterol acetate [WHO-DD]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C48149
Created by admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
Code System Code Type Description
CAS
65652-44-0
Created by admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
PRIMARY
FDA UNII
1EH73XKR9N
Created by admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
PRIMARY
ChEMBL
CHEMBL1094966
Created by admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
PRIMARY
PUBCHEM
171674
Created by admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
PRIMARY
RXCUI
221142
Created by admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
PRIMARY RxNorm
NCI_THESAURUS
C47675
Created by admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
PRIMARY
EPA CompTox
DTXSID40984214
Created by admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
PRIMARY
MERCK INDEX
m8872
Created by admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
PRIMARY Merck Index
DRUG BANK
DBSALT000799
Created by admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
PRIMARY
SMS_ID
100000092607
Created by admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
PRIMARY
ECHA (EC/EINECS)
265-862-4
Created by admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
PRIMARY
EVMPD
SUB03867MIG
Created by admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY