(-)-Epigallocatechin

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Systematic / IUPAC Name: (2R,3R)-2-(3,4,5-Trihydroxyphenyl)-3,5,7-chromanetriol

ID: Reference6131

Other Names: (-)-3,3',4',5,5',7-Flavanhexol;
epi-Gallocatechin;
3,3',4',5,5',7-Flavanhexol;
Antiscurvy factor C2;
EGC ; more

Formula: C15H14O7

Class: Endogenous Metabolites

Spectral Data

(-)-Epigallocatechin mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 1
No. of Spectra 1748
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers IT; FT
Last Modification 11/30/2016 2:29:17 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15-/m1/s1
InChI Key XMOCLSLCDHWDHP-IUODEOHRSA-N
Canonical SMILES C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)O
CAS 970741
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Other Names (-)-3,3',4',5,5',7-Flavanhexol;
epi-Gallocatechin;
3,3',4',5,5',7-Flavanhexol;
Antiscurvy factor C2;
EGC;
(-)cis-2-(3,4,5-Trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol;
(-)-cis-3,3',4',5,5',7-Hexahydroxyflavane;
(2R,3R)-2-(3,4,5-Trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol;
(2R,3R)-2-(3,4,5-Trihydroxyphenyl)chromane-3,5,7-triol;
(2R,3R)-3,4-Dihydro-2-(3,4,5-trihydroxyphenyl)-2H-1-benzopyran-3,5,7-triol;
(3,3',4',5,5',7-Hexahydroxyflavan);
1-epi-3',4',5,5',7-Pentahydroxy-3-flavan;
2-(3,4,5-Trihydroxy-phenyl)-chroman-3,5,7-triol;
2H-1-Benzopyran-3,5,7-triol, 3,4-dihydro-2-(3,4,5-trihydroxyphenyl)-, (2R-cis-)-;
2H-1-Benzopyran-3,5,7-triol,3,4-dihydro-2-(3,4,5-trihydroxyphenyl)-, (2R,3R)-;
(-)-EGC ;
NSC 674039

In Other Databases

ChemIDPlus 000970741
ChEBI CHEBI:42255
Wikipedia Gallocatechol
ChEMBL CHEMBL47386
PubChem 72277
ChemSpider 65231
HMDb HMDB38361
KEGG C12136