FL7ARXGL0002

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	566942-53-8
KEGG	{{{KEGG}}}
KNApSAcK	C00011094
CDX file
MOL file	FL7ARXGL0002.mol

5-Carboxypyranocyanidin 3-O-(6"-O-malonyl-beta-glucopyranoside)
Structural Information
Systematic Name	2-(3,4-Dihydroxyphenyl)-3-[6-O-(3-hydroxy-1,3-dioxopropyl)-beta-D-glucopyranosyloxy]-7-hydroxy-10-carboxy-5,4-(epoxyetheno)-1-benzopyrylium
Common Name	5-Carboxypyranocyanidin 3-O-(6"-O-malonyl-beta-glucopyranoside) 2-(3,4-Dihydroxyphenyl)-3-[6-O-(3-hydroxy-1,3-dioxopropyl)-beta-D-glucopyranosyloxy]-7-hydroxy-10-carboxy-5,4-(epoxyetheno)-1-benzopyrylium
Symbol
Formula	C27H23O16
Exact Mass	603.098609688
Average Mass	603.46192
SMILES	c(c5)(ccc(c5O)O)c(c(OC(O4)C(C(O)C(C4COC(=O)CC(O)=O)O)O)2)[o+1]c(c13)cc(cc1OC(C(O)=O)=Cc23)O
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
Species ID Metabolite Name Reference Allium cepa FL7ARXGL0002 See above. Fossen_T et al. 2003