FL63ACNS0006
From Metabolomics.JP
(Difference between revisions)
Line 1: | Line 1: | ||
{{Metabolite | {{Metabolite | ||
− | | | + | |Sysname=(2R)-3,4-Dihydro-2alpha-(3,4-dihydroxyphenyl)-2H-1-benzopyran-3alpha,5,7-triol 3-(3,4,5-trihydroxybenzoate) |
|Common Name=&&(-)-Epicatechin 3-O-gallate&& | |Common Name=&&(-)-Epicatechin 3-O-gallate&& | ||
|CAS=1257-08-5 | |CAS=1257-08-5 | ||
|KNApSAcK=C00008866 | |KNApSAcK=C00008866 | ||
}} | }} |
Revision as of 09:00, 12 May 2008
IDs and Links | |
---|---|
LipidBank | [1] |
LipidMaps | [2] |
CAS | 1257-08-5 |
KEGG | {{{KEGG}}} |
KNApSAcK | |
CDX file | |
MOL file | FL63ACNS0006.mol |
(-)-Epicatechin 3-O-gallate | |
---|---|
Structural Information | |
Systematic Name | |
Common Name |
|
Symbol | |
Formula | C22H18O10 |
Exact Mass | 442.089996796 |
Average Mass | 442.37232000000006 |
SMILES | Oc(c(O)1)cc(C(=O)OC(C3)C(Oc(c4)c3c(O)cc(O)4)c(c2)c |
Physicochemical Information | |
Melting Point | |
Boiling Point | |
Density | |
Optical Rotation | |
Reflactive Index | |
Solubility | |
Spectral Information | |
Mass Spectra | |
UV Spectra | |
IR Spectra | |
NMR Spectra | |
Chromatograms |