Products for Research Use Only

Ellagic acid

CAT: 0013-GTR19177036-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19177036-02Size:500 mg
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Description
Ellagic acid (Gallogen) is a natural polyphenol and a potent, ATP-competitive CK2 inhibitor with an IC50 of 40 nM. It exhibits antioxidant and antiproliferative properties, making it a valuable research tool for studying kinase signaling, oxidative stress, and cancer biology in both cellular and animal models.
CAS Number
476-66-4
Product Name Alternative
Inhibit, Inhibitor, Hedgehog, EndogenousMetabolite, Ellagic acid, Elagostasine, Gallogen, CK2, Endogenous Metabolite, CarbonicAnhydrase, Carbonic anhydrase, Carbonic Anhydrase, Casein Kinase, CaseinKinase, ReactiveOxygenSpecies, PKC, PKA, Reactive Oxygen Species, Syk, Smoothened, Topo I
Field of Research
Cardiovascular Research, Epigenetics & Chromatin, Immunology & Inflammation, Metabolism Research, Molecular Biology, Pharmacology & Drug Discovery, Signal Transduction, Stem Cell & Developmental Biology
Purity
97.11% (May vary between batches)
Solubility
DMSO:3.03 mg/mL (10.03 mM) ;10% DMSO+90% Saline:0.15 mg/mL (0.5 mM)
Smiles
OC1=CC2=C3C (OC (=O) C4=CC (O) =C (O) C (OC2=O) =C34) =C1O
Molecular Formula
C14H6O8
Molecular Weight
302.19
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Ellagic Acid

Ellagic acid is an organic heterotetracyclic compound resulting from the formal dimerisation of gallic acid by oxidative aromatic coupling with intramolecular lactonisation of both carboxylic acid groups of the resulting biaryl. It is found in many fruits and vegetables, including raspberries, strawberries, cranberries, and pomegranates. It has a role as an EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor, a geroprotector, an antioxidant, an EC 5.99.1.2 (DNA topoisomerase) inhibitor, an EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor, an EC 1.14.18.1 (tyrosinase) inhibitor, a food additive, an EC 2.5.1.18 (glutathione transferase) inhibitor, a plant metabolite, a fungal metabolite, an EC 2.3.1.5 (arylamine N-acetyltransferase) inhibitor, an EC 2.4.1.1 (glycogen phosphorylase) inhibitor, an EC 2.7.1.127 (inositol-trisphosphate 3-kinase) inhibitor, an EC 2.7.1.151 (inositol-polyphosphate multikinase) inhibitor, an EC 2.7.4.6 (nucleoside-diphosphate kinase) inhibitor and a skin lightening agent. It is a lactone, a polyphenol, a member of catechols, an organic heterotetracyclic compound and a cyclic ketone. It is functionally related to a gallic acid. It is a conjugate acid of an ellagic acid(2-).

CAS Number476-66-4
PubChem CID5281855
IUPAC Name6,7,13,14-tetrahydroxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione
Molecular FormulaC14H6O8
Molecular Weight302.19
XLogP1.1
Topological Polar Surface Area134
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count0
Heavy Atom Count22
Formal Charge0
Complexity475
SMILES
C1=C2C3=C(C(=C1O)O)OC(=O)C4=CC(=C(C(=C43)OC2=O)O)O
InChI
InChI=1S/C14H6O8/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
InChIKey
AFSDNFLWKVMVRB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ellagic Acid
CAS: 476-66-4
CID: 5281855
Formula: C14H6O8
MW: 302.19
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight302.19
XLogP31.1
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count0
Exact Mass302.00626715
Monoisotopic Mass302.00626715
Topological Polar Surface Area134 Ų
Heavy Atom Count22
Formal Charge0
Complexity475
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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