D-Saccharic acid potassium salt - 10mM in Water , CAS No.576-42-1

CAS: 576-42-1 Cat. No.: D424849 Molecular Weight: 248.23 EC Number: 209-402-2

GRADE & PURITY 10mM in Water

Synonyms

Potassium bisaccharate|576-42-1|D-Glucaric acid monopotassium salt|D-Saccharic acid potassium salt|D-Glucaric acid, monopotassium salt|POTASSIUM (2R,3R,4R,5S)-5-CARBOXY-2,3,4,5-TETRAHYDROXYPENTANOATE|potassium;(2R,3R,4R,5S)-2,3,4,5,6-pentahydroxy-6-oxohex

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Overview

D-Saccharic acid potassium salt is a compound formed from oxidizing sugars, which can be used to test for the presence of hepatic enzyme induction. Studies indicate that D-glucuronolactone dehydrogenase oxidizes D-Saccharic acid potassium salt into D-glucaro-l,4;6,3-dilactone. Alternate studies suggest that D-Saccharic acid potassium salt forms a complex with Cu(II) and H|2|O|2|to decolorize azo, acridine, triphenyl methane, anthraquinone and thiazine-based dyes.

Specifications

Synonyms

Potassium bisaccharate | 576-42-1 | D-Glucaric acid monopotassium salt | D-Saccharic acid potassium salt | D-Glucaric acid, monopotassium salt | POTASSIUM (2R, 3R, 4R, 5S)-5-CARBOXY-2, 3, 4, 5-TETRAHYDROXYPENTANOATE | potassium;(2R, 3R, 4R, 5S)-2, 3, 4, 5, 6-pentahydroxy-6-oxohex

Specifications & Purity

10mM in Water

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

This product requires cold chain shipping. Ground and other economy services are not available.

Names and Identifiers

• Canonical Smiles: C(C(C(C(=O)[O-])O)O)(C(C(=O)O)O)O.[K+]
• IUPAC Name: potassium;(2R,3R,4R,5S)-2,3,4,5,6-pentahydroxy-6-oxohexanoate
• InChIKey: UBYZGUWQNIEQMH-IAMDKXPVSA-M
• INCHI: 1S/C6H10O8.K/c7-1(3(9)5(11)12)2(8)4(10)6(13)14;/h1-4,7-10H,(H,11,12)(H,13,14);/q;+1/p-1/t1-,2-,3-,4+;/m1./s1
• Isomeric SMILES: [C@@H]([C@H]([C@H](C(=O)[O-])O)O)([C@@H](C(=O)O)O)O.[K+]
• RTECS: LZ4291900
• Molecular Weight: 248.23
• Reaxy-Rn: 18245316
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=18245316&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Class Organooxygen compounds
      • Subclass Carbohydrates and carbohydrate conjugates
        • Level5 Sugar acids and derivatives
          • Level6 Glucuronic acid derivatives

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Class: Organooxygen compounds
• Subclass: Carbohydrates and carbohydrate conjugates
• Intermediate Tree Nodes: Sugar acids and derivatives
• Direct Parent: Glucuronic acid derivatives
• Alternative Parents: Pentoses Medium-chain hydroxy acids and derivatives Medium-chain fatty acids Beta hydroxy acids and derivatives Hydroxy fatty acids Alpha hydroxy acids and derivatives Dicarboxylic acids and derivatives Secondary alcohols Carboxylic acid salts Polyols Carboxylic acids Organic potassium salts Organic oxides Carbonyl compounds Hydrocarbon derivatives Organic cations
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Glucuronic acid or derivatives - Pentose monosaccharide - Medium-chain hydroxy acid - Medium-chain fatty acid - Beta-hydroxy acid - Hydroxy fatty acid - Alpha-hydroxy acid - Dicarboxylic acid or derivatives - Fatty acyl - Fatty acid - Hydroxy acid - Monosaccharide - Carboxylic acid salt - Secondary alcohol - Organic alkali metal salt - Carboxylic acid - Carboxylic acid derivative - Polyol - Organic salt - Organic potassium salt - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic cation - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as glucuronic acid derivatives. These are compounds containing a glucuronic acid moiety (or a derivative), which consists of a glucose moiety with the C6 carbon oxidized to a carboxylic acid.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Melt Point(°C): 188° C
• Molecular Weight: 248.230 g/mol
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 5
• Exact Mass: 247.993 Da
• Monoisotopic Mass: 247.993 Da
• Topological Polar Surface Area: 158.000 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 231.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 4
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

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