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Product Overview

Product Code

CDX-00016460

CAS Number

18425-76-8

Product Format

Single Solution

Molecular Formula

C15 H20 N O9 S2 . K

Molecular Weight

461.55

Product Categories

Additional phytochemical reference materials

Documentation

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Product Information

Analyte Data

Analyte Name

Phenethyl Glucosinolate Potassium Salt (Gluconasturtiin)

CAS Number

18425-76-8

Molecular Formula

C15 H20 N O9 S2 . K

Molecular Weight

461.55

Accurate Mass

461.0217

Melting Point

171

Appearance/Form

Powder

Flash Point

Color

Off white

Odor

Odourless

SMILES

[K+].OC[C@H]1O[C@@H](SC(=NOS(=O)(=O)[O-])CCc2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O

InChI

InChI=1S/C15H21NO9S2.K/c17-8-10-12(18)13(19)14(20)15(24-10)26-11(16-25-27(21,22)23)7-6-9-4-2-1-3-5-9;/h1-5,10,12-15,17-20H,6-8H2,(H,21,22,23);/q;+1/p-1/t10-,12-,13+,14-,15+;/m1./s1

IUPAC

potassium;[[3-phenyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylpropylidene]amino] sulfate

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

UNITED STATES

Tariff Code

29389090

Product Format

Single Solution

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Product Overview

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Phenethyl Glucosinolate Potassium Salt(GluconasturtIIn)(RG)

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