D-Glucose, 2-(3,4,5-trihydroxybenzoate)

CAS Registry Number®

98917-85-2

CAS Name

D-Glucose, 2-(3,4,5-trihydroxybenzoate)

Molecular Formula

C13H16O10

Molecular Mass

332.26

Cite this Page

D-Glucose, 2-(3,4,5-trihydroxybenzoate).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=98917-85-2 (retrieved 2024-11-08) (CAS RN: 98917-85-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    150-152 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C13H16O10/c14-3-8(18)11(20)12(21)9(4-15)23-13(22)5-1-6(16)10(19)7(17)2-5/h1-2,4,8-9,11-12,14,16-21H,3H2/t8-,9+,11-,12-/m1/s1

InChIKey

InChIKey=NBZMHIIBAFCDKV-RBLKWDMZSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • D-Glucose, 2-(3,4,5-trihydroxybenzoate)
  • D-Glucose, 2-gallate

CAS INSIGHTSTM
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