3′-Hydroxypuerarin

CAS Registry Number®

117060-54-5

CAS Name

3′-Hydroxypuerarin

Molecular Formula

C21H20O10

Molecular Mass

432.38

Cite this Page

3′-Hydroxypuerarin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=117060-54-5 (retrieved 2024-11-23) (CAS RN: 117060-54-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H20O10/c22-6-14-17(27)18(28)19(29)21(31-14)15-12(24)4-2-9-16(26)10(7-30-20(9)15)8-1-3-11(23)13(25)5-8/h1-5,7,14,17-19,21-25,27-29H,6H2/t14-,17-,18+,19-,21+/m1/s1

InChIKey

InChIKey=GARZMRVWLORUSR-VPRICQMDSA-N

SMILES

OC=1C(=C2C(C(=O)C(=CO2)C3=CC(O)=C(O)C=C3)=CC1)[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O

Canonical SMILES

O=C1C(=COC=2C1=CC=C(O)C2C3OC(CO)C(O)C(O)C3O)C=4C=CC(O)=C(O)C4

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 3-(3,4-dihydroxyphenyl)-8-β-D-glucopyranosyl-7-hydroxy-
  • 3-(3,4-Dihydroxyphenyl)-8-β-D-glucopyranosyl-7-hydroxy-4H-1-benzopyran-4-one
  • 8-C-Glucosyl-7,3′,4′-trihydroxyisoflavone
  • PG 1
  • NPI 031H

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