FL5FACGS0098

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	277316-77-5
KEGG	{{{KEGG}}}
KNApSAcK	C00013870
CDX file
MOL file	FL5FACGS0098.mol

Pachyrrhizin (Euphorbia)
Structural Information
Systematic Name	2- (3,4-Dihydroxyphenyl) -5,7-dihydroxy-3- [ [ 2-O- [ 2-O- (3,4,5-trihydroxybenzoyl) -beta-D-glucopyranosyl ] -alpha-L-arabinofuranosyl ] oxy ] -4H-1-benzopyran-4-one
Common Name	Pachyrrhizin (Euphorbia) Quercetin 3- (2"'-galloylglucosyl) - (1->2) -alpha-L-arabinofuranoside 2- (3,4-Dihydroxyphenyl) -5,7-dihydroxy-3- [ [ 2-O- [ 2-O- (3,4,5-trihydroxybenzoyl) -beta-D-glucopyranosyl ] -alpha-L-arabinofuranosyl ] oxy ] -4H-1-benzopyran-4-one
Symbol
Formula	C33H32O20
Exact Mass	748.148693464
Average Mass	748.59518
SMILES	C(O)(C1O)C(OC(c(c6)cc(c(c(O)6)O)O)=O)C(OC(C(OC(=C(c(c5)cc(c(O)c5)O)3)C(=O)c(c4O)c(cc(O)c4)O3)2)C(C(O2)CO)O)OC1CO
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 Euphorbia pachyrhiza FL5FACGS0098 See above. Aimova_MZ et al. 1999