FL7AADGL0012
From Metabolomics.JP
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|SysName=3- [ [ 6-O- (1,3-Dioxo-3-hydroxypropyl) -beta-D-glucopyranosyl ] oxy ] -3'-methoxy-4',5,7-trihydroxyflavylium | |SysName=3- [ [ 6-O- (1,3-Dioxo-3-hydroxypropyl) -beta-D-glucopyranosyl ] oxy ] -3'-methoxy-4',5,7-trihydroxyflavylium | ||
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 : FL7 Anthocyani(di)n : FL7A Anthocyani(di)n : FL7AAD Peonidin (38 pages) : FL7AADGL Anthocyanin (3-Glucoside related) (28 pages)
| IDs and Links | |
|---|---|
| LipidBank | [1] |
| LipidMaps | [2] |
| CAS | 122856-11-5 |
| KEGG | {{{KEGG}}} |
| KNApSAcK | |
| CDX file | |
| MOL file | FL7AADGL0012.mol |
| Peonidin 3- (6"-malonylglucoside) | |
|---|---|
| |
| Structural Information | |
| Systematic Name | 3- [ [ 6-O- (1,3-Dioxo-3-hydroxypropyl) -beta-D-glucopyranosyl ] oxy ] -3'-methoxy-4',5,7-trihydroxyflavylium |
| Common Name |
|
| Symbol | |
| Formula | C25H25O14 |
| Exact Mass | 549.124430508 |
| Average Mass | 549.4576 |
| SMILES | O=C(CC(O)=O)OC[C@H]([C@H](O)4)O[C@H](C(C(O)4)O)Oc( |
| Physicochemical Information | |
| Melting Point | |
| Boiling Point | |
| Density | |
| Optical Rotation | |
| Reflactive Index | |
| Solubility | |
| Spectral Information | |
| Mass Spectra | |
| UV Spectra | |
| IR Spectra | |
| NMR Spectra | |
| Chromatograms | |
