glabridin

Synonyms: "4-(3,4-Dihydro-8,8-dimethyl-2H,8H-benzo(1,2-b:3,4-b')dipyran-3-yl)-1,3-benzenediol"

Source: glabridin is a chemical compound that is found in the root extract of licorice (Glycyrrhiza glabra). Glabridin is an isoflavane.

Identifiers:

IUPAC Name: 4-[(3R)-8,8-dimethyl-3,4-dihydro-2H-pyrano[2,3-f]chromen-3-yl]benzene-1,3-diol
CAS Number: 59870-68-7
PubChem ID: 124052
InChiKey: LBQIJVLKGVZRIW-ZDUSSCGKSA-N
Canonical SMILES: CC1(C=CC2=C(O1)C=CC3=C2OCC(C3)C4=C(C=C(C=C4)O)O)C

Structural Properties:

Molecular Formula: C₂₀H₂₀O₄
Molecular Weight: 324.370

Pharmacophore Features:

Number of bond donors: 2
Number of bond acceptors: 4
Number of atoms different from hydrogen: 24

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2D structure (.sdf)
3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)

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Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors

Tamir S, Eizenberg M, Somjen D, Stern N, Shelach R, Kaye A, Vaya J. 2000. Estrogenic and antiproliferative properties of glabridin from licorice in human breast cancer cells. Cancer Res 60(20):5704-5709.