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cyanidin 3-O-beta-D-galactoside

Properties

Image

Occurences in reactions

MNX_ID

MNXM94735

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₂₁H₁₉O₁₁

charge

-1

mass

447.09329

reference

chebi:77935

InChIKey

RKWHWFONKJEUEF-WVXKDWSHSA-M

InChI

InChI=1S/C21H20O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-6-10-12(25)4-9(23)5-14(10)30-20(15)8-1-2-11(24)13(26)3-8/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/p-1/t16-,17+,18+,19-,21-/m1/s1

SMILES

[O-]c1cc([O-])c2cc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(-c3ccc(O)c(O)c3)[o+]c2c1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:77935 chebi:77935	cyanidin 3-O-beta-D-galactoside 2-(3,4-dihydroxyphenyl)-3-(beta-D-galactopyranosyloxy)chromenium-5,7-diolate cyanidin 3-O-beta-D-galactoside(1-)
kegg.compound:C08647 keggC:C08647	Cyanidin 3-O-galactoside Cyanidin 3-O-beta-D-galactoside
seed.compound:cpd05553 seedM:cpd05553	Cyanidin 3-O-galactoside Cyanidin 3-O-beta-D-galactoside cyanidin 3-O-beta-D-galactose cyanidin-3-O-beta-D-galactoside
hmdb:HMDB0037977	Cyanidin 3-galactoside 2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3-chromeniumyl beta-D-galactopyranoside chloride 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1lambda⁴-chromen-1-ylium Cy3-gal Cyanidin 3-O-b-D-galactoside Cyanidin 3-O-beta-D-galactopyranoside Cyanidin 3-O-beta-D-galactoside Cyanidin 3-O-galactoside Idaein Idein cyanidin 3-O-beta-D-galactoside
CHEBI:71515 chebi:71515	cyanidin 3-O-beta-D-galactoside betaine 2-(3,4-dihydroxyphenyl)-3-(beta-D-galactopyranosyloxy)-7-hydroxychromenium-5-olate
CHEBI:27475 chebi:27475	cyanidin 3-O-beta-D-galactoside 3-(beta-D-galactopyranosyloxy)-3',4',5,7-tetrahydroxyflavylium Cyanidin 3-O-galactoside
metacyc.compound:CPD-14998 metacycM:CPD-14998	cyanidin-3-O-beta-D-galactoside cyanidin 3-O-beta-D-galactose
hmdb:HMDB37977 chebi:23428 chebi:3973 keggC:M_C08647 seedM:M_cpd05553	secondary/obsolete/fantasy identifier