Cyanidin 3-Xyloside

Copied to clipboard

Analyte Name

Cyanidin-3-xyloside chloride

CAS Number

29761-24-8

Molecular Formula

C20 H19 O10 . Cl

Molecular Weight

454.81

Accurate Mass

454.0667

SMILES

[Cl-].O[C@@H]1COC(Oc2cc3c(O)cc(O)cc3[o+]c2c4ccc(O)c(O)c4)[C@H](O)[C@H]1O

InChI

InChI=1S/C20H18O10.ClH/c21-9-4-12(23)10-6-16(30-20-18(27)17(26)14(25)7-28-20)19(29-15(10)5-9)8-1-2-11(22)13(24)3-8;/h1-6,14,17-18,20,25-27H,7H2,(H3-,21,22,23,24);1H/t14-,17+,18-,20?;/m1./s1

IUPAC

(3R,4S,5R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-chromenylium-3-yl]oxytetrahydropyran-3,4,5-triol;chloride

Storage Temperature

-20°C

Shipping Temperature

Dry ice

Country of Origin

CANADA

Product Format

Neat