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quercetin 4'-O-beta-D-glucopyranoside

Properties

Image

Occurences in reactions

MNX_ID

MNXM12838

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	0

formula

C₂₁H₂₀O₁₂

charge

mass

464.09548

reference

chebi:75839

InChIKey

OIUBYZLTFSLSBY-HMGRVEAOSA-N

InChI

InChI=1S/C21H20O12/c22-6-13-15(26)17(28)19(30)21(33-13)32-11-2-1-7(3-9(11)24)20-18(29)16(27)14-10(25)4-8(23)5-12(14)31-20/h1-5,13,15,17,19,21-26,28-30H,6H2/t13-,15-,17+,19-,21-/m1/s1

SMILES

O=c1c(O)c(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:75839 chebi:75839	quercetin 4'-O-beta-D-glucopyranoside 2-hydroxy-4-(3,5,7-trihydroxy-4-oxo-4H-chromen-2-yl)phenyl beta-D-glucopyranoside Spiraein Spiraeoside
sabiork.compound:27639 sabiorkM:27639	Quercetin 4'-O-glucoside
hmdb:HMDB0037932	Quercetin 4'-glucoside 3,5,7-trihydroxy-2-(3-hydroxy-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-4H-chromen-4-one Quercetin 4'-O-b-D-glucopyranoside Quercetin 4'-O-beta-D-glucopyranoside Quercetin 4'-O-beta-D-glucoside Quercetin 4'-O-glucoside Quercetin-4'-glucoside Spiraein Spiraeosid Spiraeoside Spireoside (6ci,7ci,8ci) spiraeoside
seed.compound:cpd23057 seedM:cpd23057	quercetin 4'-O-glucoside
metacyc.compound:CPD-11685 metacycM:CPD-11685	quercetin 4'-O-glucoside QMG
hmdb:HMDB37932 seedM:M_cpd23057	secondary/obsolete/fantasy identifier