FL5FACGS0113

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	351217-48-6
KEGG	{{{KEGG}}}
KNApSAcK	C00013885
CDX file
MOL file	FL5FACGS0113.mol

Quercetin 3-rutinoside-7- (6"-benzoylglucoside)
Structural Information
Systematic Name	7- [ (6-O-Benzoyl-beta-D-glucopyranosyl) oxy ] -3- [ [ 6-O- (6-deoxy-alpha-L-mannopyranosyl) -beta-D-glucopyranosyl ] oxy ] -2- (3,4-dihydroxyphenyl) -5-hydroxy-4H-1-benzopyran-4-one
Common Name	Quercetin 3-rutinoside-7- (6"-benzoylglucoside) 7- [ (6-O-Benzoyl-beta-D-glucopyranosyl) oxy ] -3- [ [ 6-O- (6-deoxy-alpha-L-mannopyranosyl) -beta-D-glucopyranosyl ] oxy ] -2- (3,4-dihydroxyphenyl) -5-hydroxy-4H-1-benzopyran-4-one
Symbol
Formula	C40H44O22
Exact Mass	876.232423092
Average Mass	876.7641600000001
SMILES	c(c7)ccc(c7)C(=O)OCC(C6O)OC(C(C6O)O)Oc(c1)cc(c(C(=O)3)c1OC(=C3OC(C(O)4)OC(COC(C(O)5)OC(C(O)C(O)5)C)C(O)C4O)c(c2)cc(c(c2)O)O)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 Canthium dicoccum FL5FACGS0113 See above. Gunasegaran_R et al. 2001