FL7AAAGL0038

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	144606-89-3
KEGG	{{{KEGG}}}
KNApSAcK	C00006777
CDX file
MOL file	FL7AAAGL0038.mol

Monardaein
Structural Information
Systematic Name	5- [ [ 4-O,6-O-Bis (carboxyacetyl) -beta-D-glucopyranosyl ] oxy ] -7-hydroxy-2- (4-hydroxyphenyl) -3- [ [ 6-O- [ (E) -3- (4-hydroxyphenyl) -1-oxo-2-propenyl ] -beta-D-glucopyranosyl ] oxy ] -1-benzopyrylium
Common Name	Monardaein 5- [ [ 4-O,6-O-Bis (carboxyacetyl) -beta-D-glucopyranosyl ] oxy ] -7-hydroxy-2- (4-hydroxyphenyl) -3- [ [ 6-O- [ (E) -3- (4-hydroxyphenyl) -1-oxo-2-propenyl ] -beta-D-glucopyranosyl ] oxy ] -1-benzopyrylium
Symbol
Formula	C42H41O23
Exact Mass	913.203862618
Average Mass	913.7611400000001
SMILES	O=C(OCC(O1)[C@@H]([C@H](O)[C@H](O)[C@@H]1Oc(c26)cc(cc2[o+1]c(c(c6)O[C@H](O4)C(C([C@@H](O)[C@H]4COC(=O)C=Cc(c5)ccc(c5)O)O)O)c(c3)ccc(O)c3)O)OC(CC(O)=O)=O)CC(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 Agastache aurantiaca FL7AAAGL0038 See above. Kondo_T et al. 1985 Gilia coronopifolia FL7AAAGL0038 See above. Kondo_T et al. 1985 Hyacinthus orientalis FL7AAAGL0038 See above. Kondo_T et al. 1985 Monarda didyma FL7AAAGL0038 See above. Kondo_T et al. 1985 Salvia spp. FL7AAAGL0038 See above. Kondo_T et al. 1985 Salvia splendens FL7AAAGL0038 See above. Kondo_T et al. 1989 Agastache aurantiaca FL7AAAGL0038 See above. Saito_N et al. 1992 Gilia coronopifolia FL7AAAGL0038 See above. Saito_N et al. 1992 Hyacinthus orientalis FL7AAAGL0038 See above. Saito_N et al. 1992 Monarda didyma FL7AAAGL0038 See above. Saito_N et al. 1992 Salvia spp. FL7AAAGL0038 See above. Saito_N et al. 1992