ELLAGIC ACID HYDRATE TECH. Chemical Properties

Melting point:

>300 °C(lit.)

form 

powder

InChI

1S/C14H6O8.H2O/c15-5-1-3-7-8-4(14(20)22-11(7)9(5)17)2-6(16)10(18)12(8)21-13(3)19;/h1-2,15-18H;1H2

InChIKey

UOZZJRXBNGVIKO-UHFFFAOYSA-N

SMILES

O.Oc1cc2C(=O)Oc3c(O)c(O)cc4C(=O)Oc(c1O)c2-c34

CAS DataBase Reference

314041-08-2

Safety Information

Hazard Codes 

Xi

Risk Statements 

36/37/38

Safety Statements 

26-36

WGK Germany 

3

RTECS 

DJ2620000

HS Code 

29322985

Storage Class

11 - Combustible Solids

ELLAGIC ACID HYDRATE TECH. Usage And Synthesis

Chemical Properties

green to beige powder

Uses

Ellagic acid hydrate is a natural antioxidant, and acts as a potent and ATP-competitive CK2 inhibitor, with an IC50 of 40 nM and a Ki of 20 nM[1].

IC 50

CK2: 20 nM (Ki); CK2: 40 nM (IC₅₀)

References

[1] Cozza G, et al. Identification of ellagic acid as potent inhibitor of protein kinase CK2: a successful example of a virtual screening application. J Med Chem. 2006 Apr 20;49(8):2363-6. DOI:10.1021/jm060112m

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