FL7AACGL0094

Revision as of 09:00, 15 May 2008

Cyanidin 3-O-[6-O-(malonyl)-beta-D-glucopyranoside]-7-O-[6-O-(trans-p-coumaryl)-beta-D-glucopyranoside]-3'-O-[6-O-(trans-4-O-(6-O-(trans-4-O-(beta-D-glucopyranosyl)-p-coumaryl)-beta-D-glucopyranoside]

Structural Information
Systematic Name	3,5,7,3',4'-Pentahydroxyflavylium 3-O-[6-O-(malonyl)-beta-D-glucopyranoside]-7-O-[6-O-(trans-p-coumaryl)-beta-D-glucopyranoside]-3'-O-[6-O-(trans-4-O-(6-O-(trans-4-O-(beta-D-glucopyranosyl)-p-coumaryl)-beta-D-glucopyranoside]
Common Name	Cyanidin 3-O-[6-O-(malonyl)-beta-D-glucopyranoside]-7-O-[6-O-(trans-p-coumaryl)-beta-D-glucopyranoside]-3'-O-[6-O-(trans-4-O-(6-O-(trans-4-O-(beta-D-glucopyranosyl)-p-coumaryl)-beta-D-glucopyranoside] 3,5,7,3',4'-Pentahydroxyflavylium 3-O-[6-O-(malonyl)-beta-D-glucopyranoside]-7-O-[6-O-(trans-p-coumaryl)-beta-D-glucopyranoside]-3'-O-[6-O-(trans-4-O-(6-O-(trans-4-O-(beta-D-glucopyranosyl)-p-coumaryl)-beta-D-glucopyranoside]
Symbol
Formula	C75H81O40
Exact Mass	1621.430412472
Average Mass	1622.42164
SMILES	`Oc(c1)c(OC(C(O)7)OC(COC(C=Cc(c8)ccc(OC(C%11O)OC(C(O)C%11O)COC(C=Cc(c9)ccc(OC(O%10)C(C(C(O)C%10CO)O)O)c9)=O)c8)=O)C(O)C7O)cc(c(c(OC(O6)C(O)C(O)C(C(COC(=O)CC(=O)O)6)O)5)[o+1]c(c2c5)cc(OC(C4O)OC(C(C(O)4)O)COC(=O)C=Cc(c3)ccc(c3)O)cc(O)2)c1`
Physicochemical Information
Melting Point
Boiling Point
Density
Optical Rotation
Reflactive Index
Solubility
Spectral Information
Mass Spectra
UV Spectra
IR Spectra
NMR Spectra
Chromatograms

Species-Flavonoid Relationship Reported

Species	ID	Metabolite Name	Reference
Bletilla striata	FL7AACGL0094	See above.	Saito_N et al. 1995

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 {{Metabolite
 |SysName=3,5,7,3',4'-Pentahydroxyflavylium 3-O-[6-O-(malonyl)-beta-D-glucopyranoside]-7-O-[6-O-(trans-p-coumaryl)-beta-D-glucopyranoside]-3'-O-[6-O-(trans-4-O-(6-O-(trans-4-O-(beta-D-glucopyranosyl)-p-coumaryl)-beta-D-glucopyranoside]
-|Common Name=&&Cyanidin 3-O-[6-O-(malonyl)-beta-D-glucopyranoside]-7-O-[6-O-(trans-p-coumaryl)-beta-D-glucopyranoside]-3'-O-[6-O-(trans-4-O-(6-O-(trans-4-O-(beta-D-glucopyranosyl)-p-coumaryl)-beta-D-glucopyranoside]&&
+|Common Name=&&Cyanidin 3-O-[6-O-(malonyl)-beta-D-glucopyranoside]-7-O-[6-O-(trans-p-coumaryl)-beta-D-glucopyranoside]-3'-O-[6-O-(trans-4-O-(6-O-(trans-4-O-(beta-D-glucopyranosyl)-p-coumaryl)-beta-D-glucopyranoside]&&3,5,7,3',4'-Pentahydroxyflavylium 3-O-[6-O-(malonyl)-beta-D-glucopyranoside]-7-O-[6-O-(trans-p-coumaryl)-beta-D-glucopyranoside]-3'-O-[6-O-(trans-4-O-(6-O-(trans-4-O-(beta-D-glucopyranosyl)-p-coumaryl)-beta-D-glucopyranoside]&&
 |CAS=-
 |KNApSAcK=C00011084
 }}