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cyanidin 3,7-di-O-beta-D-glucoside

Properties

Image

Occurences in reactions

MNX_ID

MNXM81886

	#reac
in my sandbox	0
in MNXref (generic)	7
in models (compartimentalized)	0

formula

C₂₇H₃₀O₁₆

charge

mass

610.15338

reference

chebi:71513

InChIKey

ULXBEUBSYSSVTP-ZOTFFYTFSA-N

InChI

InChI=1S/C27H30O16/c28-7-17-19(33)21(35)23(37)26(42-17)39-10-4-13(31)11-6-16(41-27-24(38)22(36)20(34)18(8-29)43-27)25(40-15(11)5-10)9-1-2-12(30)14(32)3-9/h1-6,17-24,26-29,33-38H,7-8H2,(H2-,30,31,32)/t17-,18-,19-,20-,21+,22+,23-,24-,26-,27-/m1/s1

SMILES

[O-]c1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2[o+]c(-c3ccc(O)c(O)c3)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc12

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:71513 chebi:71513	cyanidin 3,7-di-O-beta-D-glucoside 2-(3,4-dihydroxyphenyl)-3,7-bis(beta-D-glucopyranosyloxy)chromenium-5-olate cyanidin 3,7-di-O-beta-D-glucoside betaine
sabiork.compound:30197 sabiorkM:30197 kegg.compound:C20469 keggC:C20469	Cyanidin 3,7-di-O-beta-D-glucoside
seed.compound:cpd31119 seedM:cpd31119	Cyanidin 3,7-di-O-beta-D-glucoside cyanidin 3,7-di-O-beta-D-glucoside
metacyc.compound:CPD-15005 metacycM:CPD-15005	cyanidin 3,7-di-O-beta-D-glucoside
CHEBI:71584 chebi:71584	cyanidin 3,7-di-O-beta-D-glucoside 2-(3,4-dihydroxyphenyl)-3-(beta-D-glucopyranosyloxy)-5-hydroxychromenium-7-yl beta-D-glucopyranoside
keggC:M_C20469 seedM:M_cpd31119	secondary/obsolete/fantasy identifier