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60008-02-8

60008-02-8 Structure

60008-02-8 Structure
IdentificationBack Directory
[Name]

Glabrone
[CAS]

60008-02-8
[Synonyms]

Glabrone
7-Hydroxy-3-(5-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-4H-1-benzopyran-4-one
4H-1-Benzopyran-4-one, 7-hydroxy-3-(5-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-
[Molecular Formula]

C20H16O5
[MDL Number]

MFCD32197346
[MOL File]

60008-02-8.mol
[Molecular Weight]

336.34
Chemical PropertiesBack Directory
[Boiling point ]

554.1±50.0 °C(Predicted)
[density ]

1.368±0.06 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

Soluble in DMSO
[form ]

Solid
[pka]

6.91±0.20(Predicted)
[color ]

Light yellow to yellow
[InChI]

InChI=1S/C20H16O5/c1-20(2)8-7-14-16(25-20)6-5-12(18(14)22)15-10-24-17-9-11(21)3-4-13(17)19(15)23/h3-10,21-22H,1-2H3
[InChIKey]

COLMVFWKLOZOOP-UHFFFAOYSA-N
[SMILES]

C1OC2=CC(O)=CC=C2C(=O)C=1C1C(O)=C2C(=CC=1)OC(C)(C)C=C2
Hazard InformationBack Directory
[Uses]

Glabrone is an isoflavone isolated from Glycyrrhiza glabra roots. Glabrone exhibits anti-influenza activity and significant PPAR-γ ligand-binding activity[1][2].
[Definition]

ChEBI: Glabrone is an isoflavonoid.
[IC 50]

PPAR-γ
[storage]

Store at -20°C
[References]

[1] Grienke U, et al. Computer-guided approach to access the anti-influenza activity of licorice constituents. J Nat Prod. 2014 Mar 28;77(3):563-70. DOI:10.1021/np400817j
[2] Kuroda M, et al. Phenolics from Glycyrrhiza glabra roots and their PPAR-gamma ligand-binding activity. Bioorg Med Chem. 2010 Jan 15;18(2):962-70. DOI:10.1016/j.bmc.2009.11.027
Spectrum DetailBack Directory
[Spectrum Detail]

Glabrone(60008-02-8)1HNMR
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