Malvidin-3,5-Diglucoside Chloride(Malvin Chloride)(AS)

Analyte Name

Malvidin-3,5-diglucoside chloride(malvin chloride)

CAS Number

16727-30-3

Molecular Formula

C29 H35 O17 . Cl

Molecular Weight

691.03

Accurate Mass

690.1563

Melting Point

165

Appearance/Form

Powder

Flash Point

-20

Color

Dark red

Odor

Odourless

SMILES

[Cl-].COc1cc(cc(OC)c1O)c2[o+]c3cc(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c3cc2O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O

InChI

InChI=1S/C29H34O17.ClH/c1-40-15-3-10(4-16(41-2)20(15)33)27-17(44-29-26(39)24(37)22(35)19(9-31)46-29)7-12-13(42-27)5-11(32)6-14(12)43-28-25(38)23(36)21(34)18(8-30)45-28;/h3-7,18-19,21-26,28-31,34-39H,8-9H2,1-2H3,(H-,32,33);1H/t18-,19-,21-,22-,23+,24+,25-,26-,28-,29-;/m1./s1

IUPAC

(2S,3R,4S,5S,6R)-2-[7-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-5-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;chloride

Storage Temperature

-20°C

Shipping Temperature

Ice pack (-20°C)

Country of Origin

UNITED STATES

Tariff Code

29329900

Product Format

Single Solution