6-Hydroxy Warfarin β-D-Glucuronide D Disodium Salt Hydrate

CAS: 1007224-59-0

Ref. TR-H996110

Product Information

• Name: 6-Hydroxy Warfarin β-D-Glucuronide D Disodium Salt Hydrate
• Synonyms: 4-Hydroxy-2-oxo-3-(3-oxo-1-phenylbutyl)-2H-1-benzopyran-6-ylβ-D-Glucopyranosiduronic Acid Disodium Salt Hydrate
• Brand: TRC
• Description: Applications 6-Hydroxy Warfarin β-D-Glucuronide Disodium Salt Hydrate, is a metabolite of Warfarin (W498500) in humans.References Barbato, F., et al.: J. Pharm. Sci., 86, 225 (1997), Kavana, M., et al.: Biochemistry, 42, 10238 (2003), Franco, A., et al.: Environ. Toxicol. Chem., 28, 458 (2009),

Chemical properties

• Molecular weight: 544.421802
• Formula: C₂₅H₂₂Na₂O₁₁•xH₂O
• Color/Form: Neat
• InChI: InChI=1S/C25H24O11.2Na/c1-11(26)9-14(12-5-3-2-4-6-12)17-18(27)15-10-13(7-8-16(15)35-24(17)33)34-25-21(30)19(28)20(29)22(36-25)23(31)32;;/h2-8,10,14,19-22,25,27-30H,9H2,1H3,(H,31,32);;/q;2*+1/p-2/t14?,19-,20-,21+,22-,25+;;/m0../s1
• InChI key: InChIKey=ZKFXJEBJPRHHSB-ASZCQFDPSA-L
• SMILES: CC(=O)CC(c1ccccc1)c1c(O[Na])c2cc(O[C@@H]3O[C@H](C(=O)O[Na])[C@@H](O)[C@H](O)[C@H]3O)ccc2oc1=O