3-(β-D-Glucopyranosyloxy)-4,5-dihydroxybenzoic acid

CAS Registry Number®

91984-84-8

CAS Name

3-(β-D-Glucopyranosyloxy)-4,5-dihydroxybenzoic acid

Molecular Formula

C13H16O10

Molecular Mass

332.26

Cite this Page

3-(β-D-Glucopyranosyloxy)-4,5-dihydroxybenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=91984-84-8 (retrieved 2024-12-04) (CAS RN: 91984-84-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H16O10/c14-3-7-9(17)10(18)11(19)13(23-7)22-6-2-4(12(20)21)1-5(15)8(6)16/h1-2,7,9-11,13-19H,3H2,(H,20,21)/t7-,9-,10+,11-,13-/m1/s1

InChIKey

InChIKey=XRCRYNCPNYQMOB-JEUROIALSA-N

SMILES

O([C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C2=CC(C(O)=O)=CC(O)=C2O

Canonical SMILES

O=C(O)C1=CC(O)=C(O)C(OC2OC(CO)C(O)C(O)C2O)=C1

Other Names for this Substance

  • Benzoic acid, 3-(β-D-glucopyranosyloxy)-4,5-dihydroxy-
  • 3-(β-D-Glucopyranosyloxy)-4,5-dihydroxybenzoic acid
  • Gallic acid 3-O-β-glucoside
  • Gallic acid 3-O-glucoside

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