Cyanidin-3,5-Diglucoside(AS)

Analyte Name

Cyanidin-3,5-diglucoside

CAS Number

2611-67-8

Molecular Formula

C27 H31 O16 . Cl

Molecular Weight

646.98

Accurate Mass

646.1301

Melting Point

203-204

Appearance/Form

Powder

Flash Point

-20

Color

Brown

Odor

Odourless

SMILES

[Cl-].OC[C@H]1O[C@@H](Oc2cc3c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(O)cc3[o+]c2c5ccc(O)c(O)c5)[C@H](O)[C@@H](O)[C@@H]1O

InChI

InChI=1S/C27H30O16.ClH/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), 1H/t17-,18-,19-,20-,21+,22+,23-,24-,26-,27-, /m1./s1

IUPAC

(2S,3R,4S,5S,6R)-2-[2-(3,4-dihydroxyphenyl)-7-hydroxy-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