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Product Overview

Product Code

TRC-P218515

CAS Number

18466-51-8

Product Format

Neat

Molecular Formula

C21 H21 O10 . Cl

Molecular Weight

468.84

Product Categories

TRC

Product Type

Bioactive Small Molecule

Documentation

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Product Information

Chemical Data

Analyte Name

Pelargonidin-3-glucoside chloride

CAS Number

18466-51-8

Molecular Formula

C21 H21 O10 . Cl

Molecular Weight

468.84

Accurate Mass

468.0823

SMILES

[Cl-].OC[C@H]1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2c4ccc(O)cc4)[C@H](O)[C@@H](O)[C@@H]1O

InChI

/h1-7,16-19,21-22,26-28H,8H2,(H2-,23,24,25), /m1./s1, 1H/t16-,17-,18+,19-,21-, InChI=1S/C21H20O10.ClH/c22-8-16-17(26)18(27)19(28)21(31-16)30-15-7-12-13(25)5-11(24)6-14(12)29-20(15)9-1-3-10(23)4-2-9

IUPAC

(2S,3R,4S,5S,6R)-2-[5,7-dihydroxy-2-(4-hydroxyphenyl)chromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;chloride

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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Chemical Data

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Pelargonidin 3-Glucoside (>90%)

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