G-6-P-Na2 - 10mM in Water , CAS No.3671-99-6

CAS: 3671-99-6 Cat. No.: G423645 Molecular Weight: 304.1(anhydrous basis) Beilstein Registry Number: 5199009 EC Number: 222-938-1 PubChem CID: 18594434

GRADE & PURITY 10mM in Water

Synonyms

3671-99-6|D-Glucose-6-phosphate disodium salt|Sodium (2R,3R,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexyl phosphate|D-Glucose 6-(disodium phosphate)|d-glucose 6-phosphate disodium salt|disodium;[(2R,3R,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexyl] phosphate|D-Glucose

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Overview

An inhibitor of HXK (hexokinase).

Specifications

Synonyms

3671-99-6 | D-Glucose-6-phosphate disodium salt | Sodium (2R, 3R, 4S, 5R)-2, 3, 4, 5-tetrahydroxy-6-oxohexyl phosphate | D-Glucose 6-(disodium phosphate) | d-glucose 6-phosphate disodium salt | disodium;[(2R, 3R, 4S, 5R)-2, 3, 4, 5-tetrahydroxy-6-oxohexyl] phosphate | D-Glucose

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(C(C=O)O)O)O)O)OP(=O)([O-])[O-].[Na+].[Na+]
• IUPAC Name: disodium;[(2R,3R,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexyl] phosphate
• InChIKey: VQLXCAHGUGIEEL-FAOVPRGRSA-L
• INCHI: 1S/C6H13O9P.2Na/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14;;/h1,3-6,8-11H,2H2,(H2,12,13,14);;/q;2*+1/p-2/t3-,4+,5+,6+;;/m0../s1
• Isomeric SMILES: C([C@H]([C@H]([C@@H]([C@H](C=O)O)O)O)O)OP(=O)([O-])[O-].[Na+].[Na+]
• WGK Germany: 3
• PubChem CID: 18594434
• Molecular Weight: 304.1(anhydrous basis)
• Beilstein: 5199009

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 Beta-hydroxy aldehydes Alkyl phosphates Alpha-hydroxyaldehydes Secondary alcohols 1,2-diols Organic sodium salts Organic oxides Hydrocarbon derivatives Organic cations
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hexose monosaccharide - Monosaccharide phosphate - Beta-hydroxy aldehyde - Organic phosphoric acid derivative - Alkyl phosphate - Phosphoric acid ester - Alpha-hydroxyaldehyde - 1,2-diol - Secondary alcohol - Organic alkali metal salt - Polyol - Organic oxide - Alcohol - Organic salt - Organic sodium salt - Carbonyl group - Hydrocarbon derivative - Aldehyde - Organic cation - Aliphatic acyclic 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

• Molecular Weight: 304.100 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 6
• Exact Mass: 303.994 Da
• Monoisotopic Mass: 303.994 Da
• Topological Polar Surface Area: 170.000 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 251.000
• 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: 3

XLogP3

References

1. Dan Zhao, Mengyu Xu, Kang Dai, Huan Liu, Yan Jiao, Xincai Xiao.  (2022)  The preparation of chiral carbon dots and the study on their antibacterial abilities.  MATERIALS CHEMISTRY AND PHYSICS,      [PMID:] [10.1016/j.matchemphys.2022.127144]

2. Jinling Cui, Mingzhu Yan, Xiaoyi Liu, Shutao Yin, Shangyun Lu, Lihong Fan, Hongbo Hu.  (2019)  Inorganic Selenium Induces Nonapoptotic Programmed Cell Death in PC-3 Prostate Cancer Cells Associated with Inhibition of Glycolysis.  JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY,      [PMID:31513389] [10.1021/acs.jafc.9b03875]