Methyl β-D-glucuronide sodium salt - ≥98% , CAS No.58189-74-5

CAS: 58189-74-5 Cat. No.: M464783 Formula: C₇H₁₁NaO₇ Peso molecolare: 230.15 PubChem CID: 23718583

GRADE & PURITY ≥98%

Storage

Room temperature

Panoramica

Description

Methyl β-D-glucuronide induces the production of the enzyme β-D-glucuronidase (GUS) inEscherichia coli.Methyl β-D-glucuronide sodium salt has been used to induce the production ofEscherichia coliβ-D-glucuronidase.

Specifications

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Room temperature

Purezza

≥98%

Nomi e identificatori

Sorrisi canonici

COC1C(C(C(C(O1)C(=O)[O-])O)O)O.[Na+]

IUPAC Name

sodium;(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-methoxyoxane-2-carboxylate

InChIKey

MSQCUKVSFZTPPA-UDGZVUODSA-M

INCHI

1S/C7H12O7.Na/c1-13-7-4(10)2(8)3(9)5(14-7)6(11)12;/h2-5,7-10H,1H3,(H,11,12);/q;+1/p-1/t2-,3-,4+,5-,7+;/m0./s1

Isomeri SMILES

CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)[O-])O)O)O.[Na+]

PubChem CID

23718583

Peso molecolare

230.15

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Carbohydrates and carbohydrate conjugates
        • Level5 Sugar acids and derivatives
          • Level6 Glucuronic acid derivatives
            • Level7 Glucuronides
              • Level8 O-glucuronides

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Carbohydrates and carbohydrate conjugates
• Intermediate Tree Nodes: Sugar acids and derivatives - Glucuronic acid derivatives - Glucuronides
• Direct Parent: O-glucuronides
• Alternative Parents: O-glycosyl compounds Beta hydroxy acids and derivatives Pyrans Oxanes Monosaccharides Secondary alcohols Carboxylic acid salts Acetals Polyols Oxacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organic zwitterions Organic sodium salts Organic oxides
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: 1-o-glucuronide - O-glucuronide - Glycosyl compound - O-glycosyl compound - Beta-hydroxy acid - Hydroxy acid - Monosaccharide - Oxane - Pyran - Carboxylic acid salt - Secondary alcohol - Organoheterocyclic compound - Organic alkali metal salt - Monocarboxylic acid or derivatives - Oxacycle - Carboxylic acid - Acetal - Carboxylic acid derivative - Polyol - Organic zwitterion - Organic salt - Organic sodium salt - Hydrocarbon derivative - Carbonyl group - Organic oxide - Alcohol - Aliphatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as o-glucuronides. These are glucuronides in which the aglycone is linked to the carbohydrate unit through an O-glycosidic bond.
• 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

Proprietà chimiche e fisiche

• Peso molecolare: 230.150 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 230.04 Da
• Monoisotopic Mass: 230.04 Da
• Topological Polar Surface Area: 119.000 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 223.000
• 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: 2

XLogP3

Domande frequenti

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 58189-74-5, the molecular formula is C7H11NaO7, and the molecular weight is 230.15 g/mol. InChIKey MSQCUKVSFZTPPA-UDGZVUODSA-M.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.