Theaflavin-3'-gallate

For research use only. Not for therapeutic Use.

  • CAT Number: R025064
  • CAS Number: 28543-07-9
  • Molecular Formula: C36H28O16
  • Molecular Weight: 716.60
  • Purity: ≥95%
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Theaflavin-3′-gallate, a black tea theaflavin monomer, is regarded as the biologically important active component of black tea and provides health benefits. Theaflavin-3′-gallate acts as prooxidants and induces oxidative stress in the carcinoma cells. Theaflavin-3′-gallate reacts directly with reduced glutathione (GSH) in a time- and concentration-dependent manner[1].


Catalog Number R025064
CAS Number 28543-07-9
Synonyms

[(2R,3R)-5,7-dihydroxy-2-[3,4,5-trihydroxy-6-oxo-8-[(2R,3R)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]benzo[7]annulen-1-yl]-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate

Molecular Formula C36H28O16
Purity ≥95%
InChI InChI=1S/C36H28O16/c37-14-5-20(39)18-10-26(45)34(50-27(18)7-14)12-1-16-17(9-25(44)33(48)30(16)32(47)24(43)2-12)35-29(11-19-21(40)6-15(38)8-28(19)51-35)52-36(49)13-3-22(41)31(46)23(42)4-13/h1-9,26,29,34-35,37-42,44-46,48H,10-11H2,(H,43,47)/t26-,29-,34-,35-/m1/s1
InChIKey GPLOTACQBREROW-WQLSNUALSA-N
SMILES C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=O)C(=C4C(=C3)C(=CC(=C4O)O)C5C(CC6=C(C=C(C=C6O5)O)O)OC(=O)C7=CC(=C(C(=C7)O)O)O)O)O
Reference

[1]. Babich H, et al. Theaflavin-3-gallate and theaflavin-3′-gallate, polyphenols in black tea with prooxidant properties. Basic Clin Pharmacol Toxicol. 2008 Jul;103(1):66-74.
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