Theaflavin-3-gallate - Misplaced Pages

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Theaflavin-3-gallate
Names
File:Theaflavin-3-gallate.png
IUPAC name benzoannulen-1-yl]chroman-3-yl] 3,4,5-trihydroxybenzoate
Other names Theaflavin-3'-monogallate TFMG TF-2
Identifiers
CAS Number	28543-07-9
3D model (JSmol)	Interactive image
ChemSpider	17216344
PubChem CID	467321
CompTox Dashboard (EPA)	DTXSID30951233
InChI InChI=1S/C36H28O16/c37-15-6-20(39)17-10-25(44)34(50-26(17)8-15)13-1-12-2-19(30(45)33(48)29(12)32(47)24(43)3-13)35-28(11-18-21(40)7-16(38)9-27(18)51-35)52-36(49)14-4-22(41)31(46)23(42)5-14/h1-9,25,28,34-35,37-42,44-46,48H,10-11H2,(H,43,47)/t25-,28-,34-,35-/m1/s1Key: AATSUYYYTHJRJO-RZYARBFNSA-N InChI=1/C36H28O16/c37-15-6-20(39)17-10-25(44)34(50-26(17)8-15)13-1-12-2-19(30(45)33(48)29(12)32(47)24(43)3-13)35-28(11-18-21(40)7-16(38)9-27(18)51-35)52-36(49)14-4-22(41)31(46)23(42)5-14/h1-9,25,28,34-35,37-42,44-46,48H,10-11H2,(H,43,47)/t25-,28-,34-,35-/m1/s1Key: AATSUYYYTHJRJO-RZYARBFNBG
SMILES Oc1cc(cc(O)c1O)C(=O)O2Cc7c(O)cc(O)cc7O2c4cc3\C=C(/C=C(/O)C(=O)c3c(O)c4O)5Oc6cc(O)cc(O)c6C5O
Properties
Chemical formula	C₃₆H₂₈O₁₆
Molar mass	716.59 g/mol
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). Y verify (what is ?) Infobox references

Chemical compound

Theaflavin-3-gallate is a theaflavin derivative. It can be found in black tea.

References

v t e Thearubigins and their glycosides
Theaflavins	Theaflavin Theaflavin-3-gallate Theaflavin 3'-gallate Theaflavin 3,3' digallate Theasinensin A and B
Oxidated theaflavins	Bistheaflavin-A Bistheaflavin-B Theacitrin