β-D-Glucopyranoside, 3-hydroxy-4-(hydroxymethyl)phenyl, 6-benzoate

CAS Registry Number®

113270-18-1

CAS Name

β-D-Glucopyranoside, 3-hydroxy-4-(hydroxymethyl)phenyl, 6-benzoate

Molecular Formula

C20H22O9

Molecular Mass

406.38

Cite this Page

β-D-Glucopyranoside, 3-hydroxy-4-(hydroxymethyl)phenyl, 6-benzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=113270-18-1 (retrieved 2024-11-22) (CAS RN: 113270-18-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H22O9/c21-9-12-6-7-13(8-14(12)22)28-20-18(25)17(24)16(23)15(29-20)10-27-19(26)11-4-2-1-3-5-11/h1-8,15-18,20-25H,9-10H2/t15-,16-,17+,18-,20-/m1/s1

InChIKey

InChIKey=YUHCIIZKQMLHKK-BFMVXSJESA-N

SMILES

O([C@@H]1O[C@H](COC(=O)C2=CC=CC=C2)[C@@H](O)[C@H](O)[C@H]1O)C3=CC(O)=C(CO)C=C3

Canonical SMILES

O=C(OCC1OC(OC2=CC=C(C(O)=C2)CO)C(O)C(O)C1O)C=3C=CC=CC3

Other Names for this Substance

  • β-D-Glucopyranoside, 3-hydroxy-4-(hydroxymethyl)phenyl, 6-benzoate
  • Flacourtin

CAS INSIGHTSTM
Targeted protein degrader structure, illustration