Trichloroethyl-13C2,d2 β-D-Glucuronide Potassium Salt

CAS: 97-25-6

Ref. TR-T774112

Product Information

• Name: Trichloroethyl-13C2,d2 β-D-Glucuronide Potassium Salt
• Synonyms: [(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(2,2,2-trichloro-1,1-dideuterio(1,2-13C2)ethoxy)oxane-2-carbonyl]oxypotassium, 2,2,2-Trichloroethanol glucuronide, 2,2,2-Trichloroethyl b-D-Glucopyranosiduronic Acid, 2,2,2-Trichloroethyl b-D-Glucosiduronic Acid, 2,2,2-Trichloroethyl β-<span class="text-smallcaps">D</span>-glucopyranosiduronic acid, 97-25-6, Glucopyranosiduronic acid, 2,2,2-trichloroethyl, β-<span class="text-smallcaps">D</span>-, Urochloralic acid, beta-D-glucopyranosiduronic acid, 2,2,2-trichloroethyl, β,β,β-Trichloroethyl-β-<span class="text-smallcaps">D</span>-glucuronic acid, β,β,β-Trichloroethyl-β-<span class="text-smallcaps">D</span>-glucuronide, β-<span class="text-smallcaps">D</span>-Glucopyranosiduronic acid, 2,2,2-trichloroethyl, 2,2,2-Trichloroethyl beta-D-glucopyranosiduronic acid, β,β,β-Trichloroethyl-β-D-glucuronide, Glucopyranosiduronic acid, 2,2,2-trichloroethyl, β-D-, β,β,β-Trichloroethyl-β-D-glucuronic acid, β-D-Glucopyranosiduronic acid, 2,2,2-trichloroethyl

Description

Applications A labelled metabolite of chloral hydrate (CH) and trichloroethylene (TRI).
References Salmon, A., et al.: Clin. Toxicol., 33, 115 (1995), Xu, G., et al.: Drug Metab. Dispos., 23, 1412 (1995), Bull, R., et al.: Toxicol. Appl. Pharmacol., 182, 55 (2002),

• Brand: TRC

Chemical properties

• Molecular weight: 367.616
• Formula: C₂C₆D₂H₈Cl₃KO₇
• Color/Form: Neat
• InChI: InChI=1S/C8H11Cl3O7.K/c9-8(10,11)1-17-7-4(14)2(12)3(13)5(18-7)6(15)16;/h2-5,7,12-14H,1H2,(H,15,16);/q;+1/p-1/t2-,3-,4+,5-,7+;/m0./s1/i1+1D2,8+1
• InChI key: InChIKey=HCNYRZJUGDIUIY-QPHGYVOMSA-M
• SMILES: [2H][13C]([2H])(O[C@@H]1O[C@H](C(=O)O[K])[C@@H](O)[C@H](O)[C@H]1O)[13C](Cl)(Cl)Cl