FLIBALNP0003
From Metabolomics.JP
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{{Metabolite | {{Metabolite | ||
|SysName=Isosophoronol | |SysName=Isosophoronol | ||
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 : FLI Isoflavonoid : FLIB Isoflavanone : FLIBAL 5,7,2',(3'),4',(5'),(6')-Trihydroxyisoflavanone and O-methyl derivatives (28 pages) : FLIBALNP Pyranoflavonoid (6 pages)
| IDs and Links | |
|---|---|
| LipidBank | [1] |
| LipidMaps | [2] |
| CAS | 64280-19-9 |
| KEGG | {{{KEGG}}} |
| KNApSAcK | |
| CDX file | |
| MOL file | FLIBALNP0003.mol |
| Isosophoronol | |
|---|---|
| |
| Structural Information | |
| Systematic Name | Isosophoronol |
| Common Name |
|
| Symbol | |
| Formula | C21H20O6 |
| Exact Mass | 368.125988372 |
| Average Mass | 368.37989999999996 |
| SMILES | COc(c34)c(ccc(OC(C=C4)(C)C)3)C(C(=O)1)COc(c2)c1c(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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