FL63AGNS0001

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|SysName= (2R-cis) -3,4-Dihydro-5,7-dihydroxy-2- (3,4,5-trihydroxyphenyl) -2H-1-benzopyran-3-yl ester 3,4,5-trihydroxybenzoic acid
 
|SysName= (2R-cis) -3,4-Dihydro-5,7-dihydroxy-2- (3,4,5-trihydroxyphenyl) -2H-1-benzopyran-3-yl ester 3,4,5-trihydroxybenzoic acid

Revision as of 17:02, 18 December 2009


Flavonoid Top Molecule Index Author Index Journals Structure Search Food New Input

Upper classes : FL Flavonoid : FL6 Flavan : FL63 Flavan 3-ol :  FL63AG Gallocatechin and Epigallocatechin (23 pages) :  FL63AGNS Simple substitution (17 pages)


Gallocatechins refer to a subgroup of Flavan 3-ol derivatives (FL63AG). Compared to catechins, they have an additional phenolic hydroxyl group. Catechin gallates are gallic acid esters of the catechins, and (-)-Epigallocatechin gallate (EGCG) is the most abundant catechin in green tea but not in black tea.
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Structure FL63AGNS0002.png FL63AGNS0003.png FL63AGNS0017.png
Name (+)-Gallocatechin or
D-Gallocatechin; GC
(-)-Epigallocatechin or
L-Epigallocatechin; EGC
(-)-Gallocatechin or
L-Gallocatechin
B-ring stereo
3-Hydroxyl stereo
Gallate form FL63AGNS0004.png FL63AGNS0001.png FL63AGNS0018.png
(+)-Gallocatechin gallate or GCG (-)-Epigallocatechin gallate or EGCG (-)-Gallocatechin gallate
B-ring stereo
3-Hydroxyl stereo
Catechins (+)-Catechin (-)-Epicatechin ent-Catechin


(-) -Epigallocatechin gallate
FL63AGNS0001.png
Structural Information
Systematic Name (2R-cis) -3,4-Dihydro-5,7-dihydroxy-2- (3,4,5-trihydroxyphenyl) -2H-1-benzopyran-3-yl ester 3,4,5-trihydroxybenzoic acid
Common Name
  • (-) -Epigallocatechin gallate
  • epi-Gallocatechin 3-O-gallate
  • (2R-cis) -3,4-Dihydro-5,7-dihydroxy-2- (3,4,5-trihydroxyphenyl) -2H-1-benzopyran-3-yl ester 3,4,5-trihydroxybenzoic acid
Symbol
Formula C22H18O11
Exact Mass 458.084911418
Average Mass 458.37172000000004
SMILES C(c32)C([H])(OC(c(c4)cc(O)c(O)c(O)4)=O)C(Oc(cc(O)cc3O)2)(c(c1)cc(O)c(O)c(O)1)[H]
Physicochemical Information
Melting Point
Boiling Point
Density
Optical Rotation
Reflactive Index
Solubility
Spectral Information
Mass Spectra
UV Spectra
IR Spectra
NMR Spectra
Chromatograms



Species Information

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