Products 132929-88-5
CAS 132929-88-5 appears in our catalog under these names: 3-HC-Gluc, 1-O-(trans-3-Hydroxycotinine)-b-D-glucuronide ammonium salt. Offered by: MedChemExpress, Biosynth. Available pack sizes: Get quote, 2mg, 1mg, 5mg, 25mg, 10mg.
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
| Molecular formula | C16H20N2O8 |
|---|---|
| Molecular weight | 368.34 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 |
| InChIKey | WALNNKZUGHYSCT-MGKNELHOSA-N |
| SMILES | CN1[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)
Synonyms:
trans-3'-Hydroxycotinine-O-glucuronide, 3HC-Gluc, 3'-Hydroxycotnine-glucuronide, 3-Hydroxycotinine glucuronide, trans-3-hydroxycotinine beta-D-glucuronide, 3-HC-Gluc, trans-3'-Hydroxy Cotinine N-b-D-Glucuronide, trans-3'-Hydroxy Cotinine O-beta-D-Glucuronide, 132929-88-5(free base), trans-3a(2)-Hydroxycotinine-O-glucuronide