Feedback

cyanidin 3,5-di-O-beta-D-glucoside

Properties

Image

Occurences in reactions

MNX_ID

MNXM728628

	#reac
in my sandbox	0
in MNXref (generic)	15
in models (compartimentalized)	0

formula

C₂₇H₃₀O₁₆

charge

mass

610.15338

reference

chebi:71511

InChIKey

RDFLLVCQYHQOBU-ZOTFFYTFSA-N

InChI

InChI=1S/C27H30O16/c28-7-17-19(33)21(35)23(37)26(42-17)40-15-5-10(30)4-14-11(15)6-16(25(39-14)9-1-2-12(31)13(32)3-9)41-27-24(38)22(36)20(34)18(8-29)43-27/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)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:71511 chebi:71511	cyanidin 3,5-di-O-beta-D-glucoside 2-(3,4-dihydroxyphenyl)-3,5-bis(beta-D-glucopyranosyloxy)chromenium-7-olate cyanidin 3,5-di-O-beta-D-glucoside betaine cyanin betaine
sabiork.compound:10731 sabiorkM:10731 seed.compound:cpd05546 seedM:cpd05546 kegg.compound:C08639 keggC:C08639	Cyanin Cyanidin 3,5-O-diglucoside Cyanidin 3,5-di-O-beta-D-glucoside Cyanidin 3,5-di-O-glucoside
metacyc.compound:CPD-7138 metacycM:CPD-7138	cyanidin 3,5-di-O-beta-D-glucoside cyanidin-3,5-diglucoside cyanin
seed.compound:cpd24731 seedM:cpd24731	cyanidin-3,5-diglucoside cyanidin 3,5-di-O-beta-D-glucoside cyanin
CHEBI:3978 chebi:3978	cyanin 2-(3,4-dihydroxyphenyl)-3-(beta-D-glucopyranosyloxy)-7-hydroxychromenylium-5-yl beta-D-glucopyranoside 3,5-bis(beta-D-glucopyranosyloxy)-3',4',7-trihydroxyflavylium Cyanidin 3,5-O-diglucoside Cyanidin 3,5-di-O-glucoside Cyanidin 3,5-diglucoside Cyanin
keggC:M_C08639 seedM:M_cpd05546 seedM:M_cpd24731	secondary/obsolete/fantasy identifier