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Details

Stereochemistry RACEMIC
Molecular Formula C14H23NO3
Molecular Weight 253.3373
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of O-DEMETHYLMETOPROLOL

SMILES

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

InChI

InChIKey=CUKXSBOAIJILRY-UHFFFAOYSA-N
InChI=1S/C14H23NO3/c1-11(2)15-9-13(17)10-18-14-5-3-12(4-6-14)7-8-16/h3-6,11,13,15-17H,7-10H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C14H23NO3
Molecular Weight 253.3373
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 05:21:25 GMT 2023
Edited
by admin
on Sat Dec 16 05:21:25 GMT 2023
Record UNII
9977TAV7FG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
O-DEMETHYLMETOPROLOL
Common Name English
(±)-4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYLETHYL ALCOHOL
Systematic Name English
H 105/22
Common Name English
METOPROLOL TARTRATE IMPURITY H [EP IMPURITY]
Common Name English
BENZENEETHANOL, 4-(2-HYDROXY-3-((1-METHYLETHYL)AMINO)PROPOXY)-
Systematic Name English
SL 80-0088
Code English
METOPROLOL SUCCINATE IMPURITY H [EP IMPURITY]
Common Name English
BETAXOLOL HYDROCHLORIDE IMPURITY B [EP IMPURITY]
Common Name English
BETAXOLOL HYDROXYETHYL ANALOG
Common Name English
(±)-O-DEMETHYLMETOPROLOL
Common Name English
O-DESMETHYLMETOPROLOL
Common Name English
Code System Code Type Description
CAS
62572-94-5
Created by admin on Sat Dec 16 05:21:25 GMT 2023 , Edited by admin on Sat Dec 16 05:21:25 GMT 2023
PRIMARY
FDA UNII
9977TAV7FG
Created by admin on Sat Dec 16 05:21:25 GMT 2023 , Edited by admin on Sat Dec 16 05:21:25 GMT 2023
PRIMARY
EPA CompTox
DTXSID40978153
Created by admin on Sat Dec 16 05:21:25 GMT 2023 , Edited by admin on Sat Dec 16 05:21:25 GMT 2023
PRIMARY
PUBCHEM
162181
Created by admin on Sat Dec 16 05:21:25 GMT 2023 , Edited by admin on Sat Dec 16 05:21:25 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE ACTIVE
O-demethylmetoprolol is a pharmacologically active urinary metoprolol metabolite that has 5 to 10X less potent than metoprolol.
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