α-D-Glucose 1-phosphate dipotassium salt - ≥95% , CAS No.5996-14-5

CAS: 5996-14-5 Cat. No.: D353067 Molecular Weight: 336.32 (anhy) PubChem CID: 2724389

GRADE & PURITY ≥95%

Synonyms

dipotassium dihydrate (2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl phosphate | AKOS027382019 | H9J4583698 | Cori Ester Dipotassium Salt | alpha-Glucose-1-phosphate dipotassium dihydrate | alpha -D-Glucose 1-phosphate dipotassium salt | alp

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

α-D-Glucose 1-phosphate dipotassium salt dihydrate is the α-anomeric form of glucose which contains a phosphate group on the primary carbon. It can be converted into the deoxysugar CDP-glucose by the enzyme α-D-Glucose-1-phosphate cytidylyltransferase.

Specifications

Synonyms

dipotassium dihydrate (2R, 3R, 4S, 5S, 6R)-3, 4, 5-trihydroxy-6-(hydroxymethyl)oxan-2-yl phosphate | AKOS027382019 | H9J4583698 | Cori Ester Dipotassium Salt | alpha-Glucose-1-phosphate dipotassium dihydrate | alpha -D-Glucose 1-phosphate dipotassium salt | alp

Specifications & Purity

≥95%

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

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

Purity

≥95%

Names and Identifiers

• Pubchem Sid: 504760884
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504760884
• Canonical Smiles: C(C1C(C(C(C(O1)OP(=O)([O-])[O-])O)O)O)O.O.O.[K+].[K+]
• IUPAC Name: dipotassium;[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] phosphate;dihydrate
• InChIKey: JXLMWHHJPUWTEV-QMKHLHGBSA-L
• INCHI: 1S/C6H13O9P.2K.2H2O/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13;;;;/h2-10H,1H2,(H2,11,12,13);;;2*1H2/q;2*+1;;/p-2/t2-,3-,4+,5-,6-;;;;/m1..../s1
• Isomeric SMILES: C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OP(=O)([O-])[O-])O)O)O)O.O.O.[K+].[K+]
• WGK Germany: 3
• PubChem CID: 2724389
• Molecular Weight: 336.32 (anhy)

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Class Organooxygen compounds
      • Subclass Carbohydrates and carbohydrate conjugates
        • Level5 Monosaccharides
          • Level6 Monosaccharide phosphates

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Class: Organooxygen compounds
• Subclass: Carbohydrates and carbohydrate conjugates
• Intermediate Tree Nodes: Monosaccharides
• Direct Parent: Monosaccharide phosphates
• Alternative Parents: Hexoses Oxanes Alkyl phosphates Secondary alcohols Polyols Oxacyclic compounds Primary alcohols Organic potassium salts Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Hexose monosaccharide - Monosaccharide phosphate - Organic phosphoric acid derivative - Oxane - Phosphoric acid ester - Alkyl phosphate - Secondary alcohol - Organoheterocyclic compound - Polyol - Organic alkali metal salt - Oxacycle - Alcohol - Primary alcohol - Organic potassium salt - Hydrocarbon derivative - Organic oxide - Organic salt - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as monosaccharide phosphates. These are monosaccharides comprising a phosphated group linked to the carbohydrate unit.
• 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

• Solubility: Soluble in water (50 mg/ml).
• Sensitivity: Moisture sensitive
• Refractive Index: n20D~1.61 (Predicted)
• Melt Point(°C): 209° C (dec.)
• Molecular Weight: 372.350 g/mol
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 2
• Exact Mass: 371.963 Da
• Monoisotopic Mass: 371.963 Da
• Topological Polar Surface Area: 165.000 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 266.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 5
• 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: 5

XLogP3