FL7AAAGL0050
From Metabolomics.JP
Flavonoid Top | Molecule Index | Author Index | Journals | Structure Search | Food | New Input |
Upper classes : FL Flavonoid : FL7 Anthocyani(di)n : FL7A Anthocyani(di)n : FL7AAA Pelargonidin (96 pages) : FL7AAAGL Anthocyanin (3-Glucoside related) (75 pages)
IDs and Links | |
---|---|
LipidBank | [1] |
LipidMaps | [2] |
CAS | 202335-29-3 |
KEGG | {{{KEGG}}} |
KNApSAcK | |
CDX file | |
MOL file | FL7AAAGL0050.mol |
Pelargonidin 3- (4"'-p-coumarylrutinoside) -5-glucoside | |
---|---|
Structural Information | |
Systematic Name | 2- (4-Hydroxyphenyl) -3- [ [ 3-O- [ 3- (4-hydroxyphenyl) -1-oxo-2-propenyl ] -6-O-alpha-L-rhamnopyranosyl-beta-D-glucopyranosyl ] oxy ] -5- (beta-D-glucopyranosyloxy) -7-hydroxy-1-benzopyrylium |
Common Name |
|
Symbol | |
Formula | C42H47O21 |
Exact Mass | 887.2609835659999 |
Average Mass | 887.80998 |
SMILES | OC(C(O)3)C(C(OC3Oc(c7)c([o+1]c(c57)cc(O)cc5OC(O6)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 | ||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
|