FL3FFAGSS004

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	351224-00-5
KEGG	{{{KEGG}}}
KNApSAcK	C00013644
CDX file
MOL file	FL3FFAGSS004.mol

8-Hydroxyapigenin 8-(2",4"-disulfatoglucuronide)
Structural Information
Systematic Name	8-Hydroxyapigenin 8-(2",4"-disulfatoglucuronide)&&5,7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-8-yl beta-D-Glucopyranosiduronic acid 2,4-bis(hydrogen sulfate)
Common Name	8-Hydroxyapigenin 8-(2",4"-disulfatoglucuronide) 5,7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-8-yl beta-D-Glucopyranosiduronic acid 2,4-bis(hydrogen sulfate)
Symbol
Formula	C21H18O18S2
Exact Mass	621.993455152
Average Mass	622.48882
SMILES	C(C(OS(O)(=O)=O)4)(C(C(OC4C(O)=O)Oc(c3O)c(c(c(c3)O)2)OC(=CC(=O)2)c(c1)ccc(O)c1)OS(O)(=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 Helicteres isora FL3FFAGSS004 See above. Kamiya_K et al. 2001