3-HC-Gluc

cas: 132929-88-5 — see every product listed under this CAS number, including other names

3-HC-Gluc (CAS 132929-88-5) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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catalog numberHY-160251-Get quote
cas132929-88-5
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Trans-3-hydroxycotinine beta-D-glucuronide is a beta-D-glucosiduronic acid that is trans-3-hydroxycotinine in which the hydroxy hydrogen is replaced by a beta-D-glucuronyl residue. It has a role as a human xenobiotic metabolite and a human urinary metabolite. It is a beta-D-glucosiduronic acid, a member of pyridines and a member of pyrrolidin-2-ones. It is functionally related to a trans-3-hydroxycotinine. It is a conjugate acid of a trans-3-hydroxycotinine beta-D-glucuronide(1-).

Source: ChEBI

Identity
Molecular formulaC16H20N2O8
Molecular weight368.34 g/mol
IUPAC name(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(3R,5S)-1-methyl-2-oxo-5-pyridin-3-ylpyrrolidin-3-yl]oxyoxane-2-carboxylic acid
InChIKeyWALNNKZUGHYSCT-MGKNELHOSA-N
SMILESCN1[C@@H](C[C@H](C1=O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O)C3=CN=CC=C3

Computed by PubChem (NCBI)

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