Products 18470-06-9

CAS 18470-06-9 appears in our catalog under these names: Malvidin 3–O–glucoside, Malvidin 3-glucoside, 98%, 98%. Offered by: GLPBio, Chemat. Available pack sizes: 5mg, 1mg.

Structural formula: {0} (CAS {1})

Malvidin 3-O-beta-D-glucoside is an anthocyanin cation consisting of malvidin having a beta-D-glucosyl residue attached at the 3-hydroxy position. It has a role as a metabolite. It is a beta-D-glucoside, an anthocyanin cation and an aromatic ether. It is functionally related to a malvidin. It is a conjugate acid of a malvidin 3-O-beta-D-glucoside betaine.

Source: ChEBI

Identity
Molecular formulaC23H25O12+
Molecular weight493.4 g/mol
IUPAC name(2S,3R,4S,5S,6R)-2-[5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)chromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
InChIKeyPXUQTDZNOHRWLI-OXUVVOBNSA-O
SMILESCOC1=CC(=CC(=C1O)OC)C2=[O+]C3=CC(=CC(=C3C=C2O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O

Computed by PubChem (NCBI)