5-Hydroxypseudobaptigenin 7-O-glucoside

CAS Registry Number®

52663-80-6

CAS Name

5-Hydroxypseudobaptigenin 7-O-glucoside

Molecular Formula

C22H20O11

Molecular Mass

460.39

Cite this Page

5-Hydroxypseudobaptigenin 7-O-glucoside.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=52663-80-6 (retrieved 2025-01-31) (CAS RN: 52663-80-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H20O11/c23-6-16-19(26)20(27)21(28)22(33-16)32-10-4-12(24)17-15(5-10)29-7-11(18(17)25)9-1-2-13-14(3-9)31-8-30-13/h1-5,7,16,19-24,26-28H,6,8H2/t16-,19-,20+,21-,22-/m1/s1

InChIKey

InChIKey=MWQQQDCTBFECSA-RECXWPGBSA-N

SMILES

O=C1C=2C(=CC(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=CC2O)OC=C1C=4C=C5C(=CC4)OCO5

Canonical SMILES

O=C1C(=COC2=CC(OC3OC(CO)C(O)C(O)C3O)=CC(O)=C12)C=4C=CC=5OCOC5C4

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 3-(1,3-benzodioxol-5-yl)-7-(β-D-glucopyranosyloxy)-5-hydroxy-
  • 3-(1,3-Benzodioxol-5-yl)-7-(β-D-glucopyranosyloxy)-5-hydroxy-4H-1-benzopyran-4-one
  • 3-(5-Benzodioxolyl)-5,7-dihydroxy-4H-benzopyran-4-one 7-glucoside
  • 3′,4′-Methylenedioxyorobol-7-O-β-D-glucoside
  • 5-Hydroxypseudobaptigenin 7-O-glucoside

Deleted or Replaced CAS Registry Numbers

82052-92-4