FL631GNS0004
From Metabolomics.JP
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{{Metabolite | {{Metabolite | ||
− | |SysName= | + | |SysName= (2S,3R) -3,7,3',4',5'-Pentahydroxyflavan 3-O-gallate |
− | |Common Name=&&ent-Robinetinidol 3-O-gallate&& | + | |Common Name=&&ent-Robinetinidol 3-O-gallate&& (2S,3R) -3,7,3',4',5'-Pentahydroxyflavan 3-O-gallate&& |
|CAS=17445-91-9 | |CAS=17445-91-9 | ||
|KNApSAcK=C00008895 | |KNApSAcK=C00008895 | ||
}} | }} |
Latest revision as of 09:00, 22 September 2008
Flavonoid Top | Molecule Index | Author Index | Journals | Structure Search | Food | New Input |
Upper classes : FL Flavonoid : FL6 Flavan : FL63 Flavan 3-ol : FL631G Robinetinidol, Entrobinetinidol and O-methyl derivatives (4 pages) : FL631GNS Simple substitution (3 pages)
IDs and Links | |
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LipidBank | [1] |
LipidMaps | [2] |
CAS | 17445-91-9 |
KEGG | {{{KEGG}}} |
KNApSAcK | |
CDX file | |
MOL file | FL631GNS0004.mol |
ent-Robinetinidol 3-O-gallate | |
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Structural Information | |
Systematic Name | (2S,3R) -3,7,3',4',5'-Pentahydroxyflavan 3-O-gallate |
Common Name |
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Symbol | |
Formula | C22H18O10 |
Exact Mass | 442.089996796 |
Average Mass | 442.37232000000006 |
SMILES | Oc(c(O)1)cc(C(=O)OC(C3c(c4)cc(O)c(O)c(O)4)Cc(c(O3) |
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
Species-Flavonoid Relationship Reported | ||||||||||||
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