FL4DA9NS0009
From Metabolomics.JP
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{{Metabolite | {{Metabolite | ||
|SysName=3,5,7-Trihydroxyflavanone 3-benzoate | |SysName=3,5,7-Trihydroxyflavanone 3-benzoate | ||
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 : FL4 Dihydroflavonol : FL4DA9 5,7,(3'),(5')-Hydroxydihydroflavonol and O-methyl derivatives (25 pages) : FL4DA9NS Simple substitution (11 pages)
| IDs and Links | |
|---|---|
| LipidBank | [1] |
| LipidMaps | [2] |
| CAS | 129693-91-0 |
| KEGG | {{{KEGG}}} |
| KNApSAcK | |
| CDX file | |
| MOL file | FL4DA9NS0009.mol |
| Pinobanksin 3-benzoate | |
|---|---|
| |
| Structural Information | |
| Systematic Name | 3,5,7-Trihydroxyflavanone 3-benzoate |
| Common Name |
|
| Symbol | |
| Formula | C22H16O6 |
| Exact Mass | 376.094688244 |
| Average Mass | 376.35884000000004 |
| SMILES | c(c1)ccc(C(C(OC(=O)c(c4)cccc4)2)Oc(c3)c(c(cc3O)O)C |
| 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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