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CAS 403857-21-6

:

Phenylmethyl 2-(β-D-glucopyranosyloxy)-6-hydroxybenzoate

Description:
Phenylmethyl 2-(β-D-glucopyranosyloxy)-6-hydroxybenzoate, with the CAS number 403857-21-6, is a chemical compound that belongs to the class of benzoate esters. This substance features a phenylmethyl group, which contributes to its aromatic characteristics, and a glucopyranosyl moiety, indicating that it is a glycoside. The presence of the hydroxy group at the 6-position of the benzoate structure suggests potential for hydrogen bonding and solubility in polar solvents. The glucopyranosyl unit enhances its hydrophilicity, making it more soluble in aqueous environments compared to purely hydrophobic compounds. This compound may exhibit biological activity due to its structural components, which could interact with various biological targets. Its unique combination of hydrophilic and hydrophobic characteristics may also influence its pharmacokinetic properties, such as absorption and distribution in biological systems. Overall, this compound's structure suggests potential applications in pharmaceuticals or as a biochemical probe, although specific biological activities would require further investigation.
Formula:C20H22O9
InChI:InChI=1S/C20H22O9/c21-9-14-16(23)17(24)18(25)20(29-14)28-13-8-4-7-12(22)15(13)19(26)27-10-11-5-2-1-3-6-11/h1-8,14,16-18,20-25H,9-10H2/t14-,16-,17+,18-,20-/m1/s1
InChI key:InChIKey=GTFARABJCNHOHO-UVNCQSPWSA-N
SMILES:O(C1=C(C(OCC2=CC=CC=C2)=O)C(O)=CC=C1)[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O
Synonyms:
  • Phenylmethyl 2-(β-D-glucopyranosyloxy)-6-hydroxybenzoate
  • Benzoic acid, 2-(β-D-glucopyranosyloxy)-6-hydroxy-, phenylmethyl ester
  • Benzyl 2-O-β-D-glucopyranosyl 2,6-dihydroxybenzoate
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