5-Galloyl quinic acid

CAS Registry Number®

53584-43-3

CAS Name

5-Galloyl quinic acid

Molecular Formula

C14H16O10

Molecular Mass

344.27

Cite this Page

5-Galloyl quinic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=53584-43-3 (retrieved 2025-02-19) (CAS RN: 53584-43-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H16O10/c15-6-1-5(2-7(16)10(6)18)12(20)24-9-4-14(23,13(21)22)3-8(17)11(9)19/h1-2,8-9,11,15-19,23H,3-4H2,(H,21,22)/t8-,9-,11+,14-/m1/s1

InChIKey

InChIKey=LDPLFHGGZNSKDS-AOGLXQGOSA-N

SMILES

O(C(=O)C1=CC(O)=C(O)C(O)=C1)[C@@H]2C[C@](C(O)=O)(O)C[C@@H](O)[C@@H]2O

Canonical SMILES

O=C(O)C1(O)CC(O)C(O)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1

Other Names for this Substance

  • Benzoic acid, 3,4,5-trihydroxy-, (1R,2S,3R,5R)-5-carboxy-2,3,5-trihydroxycyclohexyl ester
  • Benzoic acid, 3,4,5-trihydroxy-, 5-carboxy-2,3,5-trihydroxycyclohexyl ester, [1R-(1α,2α,3β,5α)]-
  • 5-Galloyl quinate
  • 5-Galloyl quinic acid

CAS INSIGHTSTM
Lithium-ion battery