FL2FA9GS0001

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	13241-31-1
KEGG	{{{KEGG}}}
KNApSAcK	C00000993
CDX file
MOL file	FL2FA9GS0001.mol

Pinocembrin 7-O-neohesperidoside
Structural Information
Systematic Name	(2S)-2-cyclohexyl-7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxychroman-4-one
Common Name	Pinocembrin 7-O-neohesperidoside Pinocembrin 7-rhamnosylglucoside (2S)-2-cyclohexyl-7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxychroman-4-one
Symbol
Formula	C27H31HO13
Exact Mass	564.18429111
Average Mass	564.53518
SMILES	O=C(c41)CC([H])(c(c5)cccc5)Oc(cc(cc4O)OC(C2OC(O3)C(C(O)C(O)C(C)3)O)OC(CO)C(C2O)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 Nierembergia hippomanica FL2FA9GS0001 See above. Kutney_JP et al. 1970 Sparattosperma vernicosum FL2FA9GS0001 See above. Kutney_JP et al. 1970 Nierembergia hippomanica FL2FA9GS0001 See above. Pomilio_AB et al. 1979 Sparattosperma vernicosum FL2FA9GS0001 See above. Pomilio_AB et al. 1979 Onychium japonicum FL2FA9GS0001 See above. Xu_Y et al. 1993