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CAS 146275-15-2

:

COTININE-N-(4-DEOXY-4,5-DIDEHYDRO)-?-D-GLUCURONIDE

Description:
Cotinine-N-(4-deoxy-4,5-didehydro)-β-D-glucuronide is a metabolite of cotinine, which is a primary metabolite of nicotine. This compound is characterized by its glucuronidation, a biochemical process where a glucuronic acid moiety is conjugated to a substrate, enhancing its solubility and facilitating excretion. The presence of the 4-deoxy-4,5-didehydro modification indicates structural alterations that may influence its biological activity and pharmacokinetics. Cotinine itself is known for its relatively long half-life compared to nicotine, and its glucuronide forms are often used as biomarkers for tobacco exposure in biological samples. The compound is typically analyzed using techniques such as liquid chromatography coupled with mass spectrometry (LC-MS) due to its complex structure and the need for sensitivity in detection. Understanding the characteristics of this glucuronide can provide insights into nicotine metabolism and the physiological effects of tobacco use.
Formula:C16H18N2O6
InChI:InChI=1/C16H18N2O6/c1-17-10(4-5-13(17)20)9-3-2-6-18(8-9)15-14(21)11(19)7-12(24-15)16(22)23/h2-3,6-8,10-11,14-15,19,21H,4-5H2,1H3/t10-,11+,14+,15-/m0/s1
Synonyms:
  • N-(-D-4-Deoxy-4,5-didehydroglucopyranosyl)uronate, Cotinium Inner Salt
  • COTININE-N-(4-DEOXY-4,5-DIDEHYDRO)-?-D-GLUCURONIDE
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