Product Information
Name:Montelukast Acyl-β-D-glucuronide-d6
Controlled Product
Synonyms:
- 1-[1-[[[(1R)-1-[3-[(1E)-2-(7-Chloro-2-quinolinyl)ethenyl]phenyl]-3-[2-(1-hydroxy-1-methylethyl-d6)phenyl]propyl]thio]methyl]cyclopropaneacetate] beta-D-Glucopyranuronic Acid
Brand:TRC
Description:Applications A labelled metabolite of Montelukast.References Madan, A., et al.: Biochem. Pharmacol., 46, 2291 (1993), Blake, B.L., et al.: Xenobiotica, 25, 377 (1995), LaBelle, M., et al.: Bioorg. Med. Chem. Lett., 5, 283 (1995), Chiba, M., et al.: Drug Metab. Dispos., 24, 307 (1996),
Notice:Our products are intended for lab use only. For any other use, please contact us.
Chemical properties
Molecular weight:768.344
Formula:C41D6H38ClNO9S
Color/Form:Neat
InChI:InChI=1S/C41H44ClNO9S/c1-40(2,50)30-9-4-3-7-25(30)13-17-32(27-8-5-6-24(20-27)10-15-29-16-12-26-11-14-28(42)21-31(26)43-29)53-23-41(18-19-41)22-33(44)51-39-36(47)34(45)35(46)37(52-39)38(48)49/h3-12,14-16,20-21,32,34-37,39,45-47,50H,13,17-19,22-23H2,1-2H3,(H,48,49)/b15-10+/t32-,34+,35+,36-,37+,39-/m1/s1/i1D3,2D3
InChI key:InChIKey=SXJRVQZUUOADNS-AWICEQSPSA-N
SMILES:[2H]C([2H])([2H])C(O)(c1ccccc1CC[C@@H](SCC1(CC(=O)O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)CC1)c1cccc(/C=C/c2ccc3ccc(Cl)cc3n2)c1)C([2H])([2H])[2H]
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