4-​[[4-​(Phenylmethoxy)​phenyl]​methyl]​-phenol O-a-D-Glucuronic Acid Methyl Ester

Ref. TR-P338290

Información del producto

• Nombre: 4-​[[4-​(Phenylmethoxy)​phenyl]​methyl]​-phenol O-a-D-Glucuronic Acid Methyl Ester
• Sinónimos: (2S,3S,4S,5R,6S)-Methyl 6-(4-(4-(Benzyloxy)benzyl)phenoxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylate

Descripción

Applications 4-​[[4-​(Phenylmethoxy)​phenyl]​methyl]​-phenol O-α-D-Glucuronic Acid Methyl Ester is an intermediate in synthesizing Bisphenol F Mono-β-D-glucuronide (B519598), a metabolite of Bisphenol F (B519555), which is a bisphenol derivative with antioxidant activities that has been reported to exhibit estrogen agonistic properties.
References Pospisil, J. et al.: Kinet. Mech. Polyreacti.Int. Symp. Macromol. Chem. Prepr., 5, 383 (1969); Kanai, H. et al.: Int. J. Cancer, 93, 20 (2001); Higashihara, N. et al.: Arch. Toxicol., 81, 825 (2007)

• Marca: TRC

Propiedades químicas

• Peso molecular: 480.51
• Fórmula: C₂₇H₂₈O₈
• Color/Forma: Neat
• InChI: InChI=1S/C27H28O8/c1-32-26(31)25-23(29)22(28)24(30)27(35-25)34-21-13-9-18(10-14-21)15-17-7-11-20(12-8-17)33-16-19-5-3-2-4-6-19/h2-14,22-25,27-30H,15-16H2,1H3/t22-,23-,24+,25-,27+/m0/s1
• Clave InChI: InChIKey=BWUWPMXXJLLYKA-GAYSTUHSSA-N
• SMILES: COC(=O)[C@H]1O[C@@H](Oc2ccc(Cc3ccc(OCc4ccccc4)cc3)cc2)[C@H](O)[C@@H](O)[C@@H]1O