FL5FACGS0094
From Metabolomics.JP
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{{Metabolite | {{Metabolite | ||
| − | | | + | |SysName=2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-3-yl beta-D-glucopyranosiduronic acid butyl ester |
|Common Name=&&Parthenosin&&Quercetin 3-(6"-n-butylglucuronide)&&2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-3-yl beta-D-glucopyranosiduronic acid butyl ester&& | |Common Name=&&Parthenosin&&Quercetin 3-(6"-n-butylglucuronide)&&2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-3-yl beta-D-glucopyranosiduronic acid butyl ester&& | ||
|CAS=166196-16-3 | |CAS=166196-16-3 | ||
|KNApSAcK=C00013866 | |KNApSAcK=C00013866 | ||
}} | }} | ||
Revision as of 09:00, 13 May 2008
| IDs and Links | |
|---|---|
| LipidBank | [1] |
| LipidMaps | [2] |
| CAS | 166196-16-3 |
| KEGG | {{{KEGG}}} |
| KNApSAcK | |
| CDX file | |
| MOL file | FL5FACGS0094.mol |
| Parthenosin | |
|---|---|
| |
| Structural Information | |
| Systematic Name | 2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-3-yl beta-D-glucopyranosiduronic acid butyl ester |
| Common Name |
|
| Symbol | |
| Formula | C25H26O13 |
| Exact Mass | 534.137340918 |
| Average Mass | 534.46614 |
| SMILES | c(c12)c(cc(O)c(C(C(OC(C(O)4)OC(C(O)C4O)C(=O)OCCCC) |
| Physicochemical Information | |
| Melting Point | |
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| 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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