Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C13H18O3 |
| Molecular Weight | 222.2802 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C(O)=O)C1=CC=C(CC(C)(C)O)C=C1
InChI
InChIKey=UJHKVYPPCJBOSG-UHFFFAOYSA-N
InChI=1S/C13H18O3/c1-9(12(14)15)11-6-4-10(5-7-11)8-13(2,3)16/h4-7,9,16H,8H2,1-3H3,(H,14,15)
| Molecular Formula | C13H18O3 |
| Molecular Weight | 222.2802 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
Approval Year
PubMed
| Title | Date | PubMed |
|---|---|---|
| Behaviour of pharmaceutical products and biodegradation intermediates in horizontal subsurface flow constructed wetland. A microcosm experiment. | 2008-05-01 |
|
| Elimination of pharmaceuticals and personal care products in subsurface flow constructed wetlands. | 2006-09-15 |
|
| Pathways and metabolites of microbial degradation of selected acidic pharmaceutical and their occurrence in municipal wastewater treated by a membrane bioreactor. | 2005-07 |
|
| The secretion of ibuprofen metabolites interferes with the capillary chromatography of urinary homovanillic acid and 4-hydroxy-3-methoxymandelic acid in neuroblastoma diagnosis. | 2005 |
|
| Determination of selected pharmaceuticals and caffeine in sewage and seawater from Tromsø/Norway with emphasis on ibuprofen and its metabolites. | 2004-08 |
|
| Effect of Tamarindus indica. L on the bioavailability of ibuprofen in healthy human volunteers. | 2003-10-07 |
|
| Effect of sodium/potassium salt (potash) on the bioavailability of ibuprofen in healthy human volunteers. | 2003-07-25 |
|
| Metabolites from the biodegradation of pharmaceutical residues of ibuprofen in biofilm reactors and batch experiments. | 2002-02 |
|
| Selective degradation of ibuprofen and clofibric acid in two model river biofilm systems. | 2001-09 |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 21:30:42 GMT 2025
by
admin
on
Mon Mar 31 21:30:42 GMT 2025
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| Record UNII |
2KHZ9ELM84
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| Record Status |
Validated (UNII)
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| Record Version |
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133197
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DTXSID30873789
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10443535
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51146-55-5
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2KHZ9ELM84
Created by
admin on Mon Mar 31 21:30:42 GMT 2025 , Edited by admin on Mon Mar 31 21:30:42 GMT 2025
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE ACTIVE |
MAJOR
URINE
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