FL7AAAGL0007
From Metabolomics.JP
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{{Metabolite | {{Metabolite | ||
| − | | | + | |SysName=2-(4-Hydroxyphenyl)-3-[(6-O-alpha-L-rhamnopyranosyl-beta-D-glucopyranosyl)oxy]-5,7-dihydroxy-1-benzopyrylium |
|Common Name=&&Pelargonidin 3-rutinoside&& | |Common Name=&&Pelargonidin 3-rutinoside&& | ||
|CAS=33978-17-5 | |CAS=33978-17-5 | ||
|KNApSAcK=C00006639 | |KNApSAcK=C00006639 | ||
}} | }} | ||
Revision as of 09:00, 13 May 2008
| IDs and Links | |
|---|---|
| LipidBank | [1] |
| LipidMaps | [2] |
| CAS | 33978-17-5 |
| KEGG | {{{KEGG}}} |
| KNApSAcK | |
| CDX file | |
| MOL file | FL7AAAGL0007.mol |
| Pelargonidin 3-rutinoside | |
|---|---|
| |
| Structural Information | |
| Systematic Name | 2-(4-Hydroxyphenyl)-3-[(6-O-alpha-L-rhamnopyranosyl-beta-D-glucopyranosyl)oxy]-5,7-dihydroxy-1-benzopyrylium |
| Common Name |
|
| Symbol | |
| Formula | C27H31O14 |
| Exact Mass | 579.1713807 |
| Average Mass | 579.52664 |
| SMILES | O(C1C)C(OCC(O2)C(O)C(C(C2Oc(c4c(c5)ccc(O)c5)cc(c3[ |
| Physicochemical Information | |
| Melting Point | |
| Boiling Point | |
| Density | |
| Optical Rotation | |
| Reflactive Index | |
| Solubility | |
| Spectral Information | |
| Mass Spectra | |
| UV Spectra | |
| IR Spectra | |
| NMR Spectra | |
| Chromatograms | |
