trans-3'-Hydroxy Cotinine O-β-D-Glucuronide Ammonium Salt

CAS: 132929-88-5

Ref. TR-H924575

Product Information

• Name: trans-3'-Hydroxy Cotinine O-β-D-Glucuronide Ammonium Salt
• Synonyms: (3R,5S)-1-Methyl-2-oxo-5-(3-pyridinyl)-3-pyrrolidinyl ß-D-Glucopyranosiduronic Acid Monoammonium Salt, trans-3'-Hydroxycotinine-O-glucuronide Monoammonium Salt, (3R,5S)-1-Methyl-2-oxo-5-(3-pyridinyl)-3-pyrrolidinyl β-<span class="text-smallcaps">D</span>-glucopyranosiduronic acid, (3R,5S)-1-methyl-2-oxo-5-(pyridin-3-yl)pyrrolidin-3-yl beta-D-glucopyranosiduronic acid, 1-O-(trans-3-Hydroxycotinine)-b-D-glucuronide, trans-3'-Hydroxycotinine O--D-glucuronide, trans-3′-Hydroxycotinine-O-glucuronide, β-<span class="text-smallcaps">D</span>-Glucopyranosiduronic acid, (3R,5S)-1-methyl-2-oxo-5-(3-pyridinyl)-3-pyrrolidinyl, β-<span class="text-smallcaps">D</span>-Glucopyranosiduronic acid, 1-methyl-2-oxo-5-(3-pyridinyl)-3-pyrrolidinyl, (3R-trans)-

Description

Stability Hygroscopic
Applications A Nicotine (N412420) metabolite. Carcinogen.
References Le Marchand, L., et al.: Cancer Res., 58, 4858 (1998), Minna, J., et al.: J. Clin. Invest., 111, 31 (2003), Bierut, L., et al.: Hum. Mol. Genet., 16, 24 (2007), Thorgeirsson, T., et al.: Nature, 452, 638 (2008),

• Brand: TRC

Chemical properties

• Molecular weight: 368.34 + x(17.03)
• Formula: C₁₆H₂₀N₂O₈·x(NH₃)
• Color/Form: White To Pale Beige Solid
• InChI: InChI=1S/C16H20N2O8.H3N/c1-18-8(7-3-2-4-17-6-7)5-9(14(18)22)25-16-12(21)10(19)11(20)13(26-16)15(23)24;/h2-4,6,8-13,16,19-21H,5H2,1H3,(H,23,24);1H3/t8-,9+,10-,11-,12+,13-,16+;/m0./s1