FL7AAHGL0014

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食品情報

新規入力

Upper classes : FL Flavonoid : FL7 Anthocyani(di)n : FL7A Anthocyani(di)n :  FL7AAH Petunidin (31 pages) :  FL7AAHGL Anthocyanin (3-Glucoside related) (23 pages)

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	163857-14-5
KEGG	{{{KEGG}}}
KNApSAcK	C00006899
CDX file
MOL file	FL7AAHGL0014.mol

Petunidin 3- (6"-p-coumarylglucoside) -5- (6"'-malonylglucoside)
Structural Information
Systematic Name	2- (3,4-Dihydroxy-5-methoxyphenyl) -5- [ 6-O- (2-carboxyacetyl) -beta-D-glucopyranosyloxy ] -7-hydroxy-3- [ 6-O- [ 3- (4-hydroxyphenyl) acryloyl ] -beta-D-glucopyranosyloxy ] -1-benzopyrylium
Common Name	Petunidin 3- (6"-p-coumarylglucoside) -5- (6"'-malonylglucoside) 2- (3,4-Dihydroxy-5-methoxyphenyl) -5- [ 6-O- (2-carboxyacetyl) -beta-D-glucopyranosyloxy ] -7-hydroxy-3- [ 6-O- [ 3- (4-hydroxyphenyl) acryloyl ] -beta-D-glucopyranosyloxy ] -1-benzopyrylium
Symbol
Formula	C40H41O22
Exact Mass	873.208947996
Average Mass	873.7403400000001
SMILES	C(OC(=O)CC(O)=O)C(C1O)OC(Oc(c24)cc(O)cc2[o+1]c(c(OC(O5)C(C(O)C(C5COC(C=Cc(c6)ccc(O)c6)=O)O)O)c4)c(c3)cc(c(c3OC)O)O)C(O)C(O)1
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 Hyacinthus orientalis FL7AAHGL0014 See above. Hosokawa_K et al. 1995