α-Sophorose hydrate - ≥98% , CAS No.20429-79-2

CAS: 20429-79-2 Cat. No.: S120974 Fórmula: C₁₂H₂₂O₁₁·xH₂O Peso molecular: 342.30（anhy）

GRADE & PURITY ≥98%

Synonyms

2-O-β-D-Glucopyranosyl-D-glucopyranose hydrate | β-D-Glc-(1→2)-D-Glc hydrate | 2-O-beta-D-Glucopyranosyl-D-glucopyranose hydrate | b-D-Glc-(1→2)-D-Glc hydrate | 2-O-(b-D-Glucopyranosyl)-a-D-glucose hydrate

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Descripción general

a-Sophorose hydrate is a water soluble β 1-2’ diglucoside which can be used to induce cellulase production from fungi. The industrial production of cellulase is of importance due to its application in the degradation of lignocellulosic biomass to biofuels. a-Sophorose hydrate is also a useful chemical building block for carbohydrate synthesis.

Specifications

Sinónimos

2-O-β-D-Glucopyranosyl-D-glucopyranose hydrate | β-D-Glc-(1→2)-D-Glc hydrate | 2-O-beta-D-Glucopyranosyl-D-glucopyranose hydrate | b-D-Glc-(1→2)-D-Glc hydrate | 2-O-(b-D-Glucopyranosyl)-a-D-glucose hydrate

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at -20°C

Enviado en

Ice chest + Ice pads

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

Pubchem Sid

488198020

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488198020

Sonrisas canónicas

C(C1C(C(C(C(O1)O)OC2C(C(C(C(O2)CO)O)O)O)O)O)O

IUPAC Name

(3R,4S,5S,6R)-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2,4,5-triol

InChIKey

HIWPGCMGAMJNRG-RTPHMHGBSA-N

INCHI

1S/C12H22O11/c13-1-3-6(16)8(18)10(11(20)21-3)23-12-9(19)7(17)5(15)4(2-14)22-12/h3-20H,1-2H2/t3-,4-,5-,6-,7+,8+,9-,10-,11?,12+/m1/s1

Isómeros SMILES

C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](OC2O)CO)O)O)O)O)O)O

WGK Alemania

3

Peso molecular

342.30（anhy）

Reaxy-Rn

25969951

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=25969951&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds
      • Subclass Carbohydrates and carbohydrate conjugates
        • Level5 Glycosyl compounds
          • Level6 O-glycosyl compounds

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Carbohydrates and carbohydrate conjugates
• Intermediate Tree Nodes: Glycosyl compounds
• Direct Parent: O-glycosyl compounds
• Alternative Parents: Disaccharides Oxanes Secondary alcohols Hemiacetals Polyols Oxacyclic compounds Acetals Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: O-glycosyl compound - Disaccharide - Oxane - Secondary alcohol - Hemiacetal - Oxacycle - Organoheterocyclic compound - Polyol - Acetal - Hydrocarbon derivative - Primary alcohol - Alcohol - Aliphatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as o-glycosyl compounds. These are glycoside in which a sugar group is bonded through one carbon to another group via a 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

Propiedades químicas y físicas

• Solubilidad: water: 50 mg/mL, clear, colorless
• Sensibilidad: Moisture sensitive
• Peso molecular: 342.300 g/mol
• XLogP3: -4.200
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 4
• Exact Mass: 342.116 Da
• Monoisotopic Mass: 342.116 Da
• Topological Polar Surface Area: 190.000 Ų
• Heavy Atom Count: 23
• Formal Charge: 0
• Complexity: 382.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 9
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Preguntas frecuentes

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 ?20 °C. Freezer storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

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

The CAS Number is 20429-79-2, the molecular formula is C12H22O11·xH2O, and the molecular weight is 342.30（anhy） g/mol. InChIKey HIWPGCMGAMJNRG-RTPHMHGBSA-N.

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.