32494
3-Hydroxyibuprofen
VETRANAL®, analytical standard
Synonym(s):
2-[4-(3-Hydroxy-2-methylpropyl)phenyl]propionic acid
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About This Item
Empirical Formula (Hill Notation):
C13H18O3
CAS Number:
Molecular Weight:
222.28
UNSPSC Code:
41116107
NACRES:
NA.24
PubChem Substance ID:
MDL number:
Beilstein/REAXYS Number:
9848786
InChI
1S/C13H18O3/c1-9(8-14)7-11-3-5-12(6-4-11)10(2)13(15)16/h3-6,9-10,14H,7-8H2,1-2H3,(H,15,16)
SMILES string
CC(CO)Cc1ccc(cc1)C(C)C(O)=O
InChI key
HFAIHLSDLUYLQA-UHFFFAOYSA-N
grade
analytical standard
product line
VETRANAL®
shelf life
limited shelf life, expiry date on the label
technique(s)
HPLC: suitable, gas chromatography (GC): suitable
application(s)
forensics and toxicology
pharmaceutical (small molecule)
format
neat
Quality Level
General description
Ibuprofen (Ibu) is an anti-inflammatory drug, and it is metabolized in the human liver to a number of metabolites including 1-hydroxyibuprofen (1-OH-Ibu), 2-hydroxyibuprofen (2-OH-Ibu), and 3-hydroxyibuprofen (3-OH-Ibu).
Application
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.
Legal Information
VETRANAL is a registered trademark of Merck KGaA, Darmstadt, Germany
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Production and NMR analysis of the human ibuprofen metabolite 3-hydroxyibuprofen.
Neunzig, Ina, et al.
Journal of Biotechnology, 157 (3), 417-420 (2012)
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