Products 4192-31-8
CAS 4192-31-8 appears in our catalog under these names: Cotinine Impurity 1, Gamma-Oxo-3-pyridinebutyric Acid, >95% (HPLC), 1-(3-Pyridyl)-1-butanone-4-carboxylic Acid, 95%, γ-Oxo-3-pyridinebutyric acid, 4-Oxo-4-(3-pyridyl)butyric acid, 95%, 95%. Offered by: Chemat Brand, TRC, AmBeed, Biosynth, Chemat. Available pack sizes: on request, 10mg, 25mg, 5mg, 5g, 10g, 1000mg, 50mg.
4-oxo-4-(pyridin-3-yl)butanoic acid is a monocarboxylic acid that is succinic acid in which the hydroxy group of one of the carboxy groups is replaced by a pyridin-3-yl group. A byproduct of tobacco-specific N-nitrosamines generated by cytochrome P-450 which catalyzes methylnitrosaminopyridylbutanone hydroxylation, this nicotine metabolite is commonly found in the urine of smokers. It is a monocarboxylic acid, a member of pyridines and an aromatic ketone. It is functionally related to a 4-oxo-4-(pyridin-3-yl)butanal. It is a conjugate acid of a 4-oxo-4-(pyridin-3-yl)butanoate.
Source: ChEBI
| Molecular formula | C9H9NO3 |
|---|---|
| Molecular weight | 179.17 g/mol |
| IUPAC name | 4-oxo-4-pyridin-3-ylbutanoic acid |
| InChIKey | JGSUNMCABQUBOY-UHFFFAOYSA-N |
| SMILES | C1=CC(=CN=C1)C(=O)CCC(=O)O |
Computed by PubChem (NCBI)
Synonyms:
4-oxo-4-(pyridin-3-yl)butanoic acid, 4-Oxo-4-(3-pyridyl)butyric acid, 4-oxo-4-(3-pyridyl)butanoic acid, gamma-oxo-3-pyridinebutanoic acid, 4-oxo-4-(3-pyridyl)-butanoic acid, 3-succinoylpyridine, 4-Oxo-4-pyridin-3-yl-butyric acid, 4-oxo-4-pyridin-3-ylbutanoic acid, gamma-oxo-3-pyridinebutyric acid, 1-(3-pyridyl)-1-butanone-4-carboxylic acid