1，3，4，6-Tetra-O-acetyl-2-amino-2-deoxy-β -D-glucopyranose Hydrochloride - ≥97% , CAS No.10034-20-5

CAS: 10034-20-5 Cat. No.: T132336 Peso molecular: 383.78 PubChem CID: 202259

GRADE & PURITY ≥97%

Synonyms

beta-D-Glucopyranose, 2-amino-2-deoxy-, 1,3,4,6-tetraacetate, hydrochloride | SCHEMBL1898600 | 1,3,4,6-tetra-o-acetyl-a-d-glucosaminehci | (2S,3R,4R,5S,6R)-6-(acetoxymethyl)-3-amino-tetrahydro-2H-pyran-2,4,5-triyl triacetate hydrochloride | (2S,3R,4R,5S,6

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

beta-D-Glucopyranose, 2-amino-2-deoxy-, 1, 3, 4, 6-tetraacetate, hydrochloride | SCHEMBL1898600 | 1, 3, 4, 6-tetra-o-acetyl-a-d-glucosaminehci | (2S, 3R, 4R, 5S, 6R)-6-(acetoxymethyl)-3-amino-tetrahydro-2H-pyran-2, 4, 5-triyl triacetate hydrochloride | (2S, 3R, 4R, 5S, 6

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Argon charged

Enviado en

Wet ice

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

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 504757818
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504757818
• Sonrisas canónicas: CC(=O)OCC1C(C(C(C(O1)OC(=O)C)N)OC(=O)C)OC(=O)C.Cl
• IUPAC Name: [(2R,3S,4R,5R,6S)-3,4,6-triacetyloxy-5-aminooxan-2-yl]methyl acetate;hydrochloride
• InChIKey: BQLUYAHMYOLHBX-XAWYEFCRSA-N
• INCHI: 1S/C14H21NO9.ClH/c1-6(16)20-5-10-12(21-7(2)17)13(22-8(3)18)11(15)14(24-10)23-9(4)19;/h10-14H,5,15H2,1-4H3;1H/t10-,11-,12-,13-,14-;/m1./s1
• Isómeros SMILES: CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC(=O)C)N)OC(=O)C)OC(=O)C.Cl
• WGK Alemania: 3
• PubChem CID: 202259
• Peso molecular: 383.78

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds
      • Subclass Carbohydrates and carbohydrate conjugates
        • Level5 Aminosaccharides
          • Level6 Aminoglycosides

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Carbohydrates and carbohydrate conjugates
• Intermediate Tree Nodes: Aminosaccharides
• Direct Parent: Aminoglycosides
• Alternative Parents: Tetracarboxylic acids and derivatives Oxanes Monosaccharides Carboxylic acid esters Amino acids and derivatives Oxacyclic compounds Acetals Organopnictogen compounds Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Aminoglycoside core - Tetracarboxylic acid or derivatives - Oxane - Monosaccharide - Carboxylic acid ester - Amino acid or derivatives - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Acetal - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Hydrochloride - Primary amine - Organonitrogen compound - Primary aliphatic amine - Carbonyl group - Amine - Aliphatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as aminoglycosides. These are molecules or a portion of a molecule composed of amino-modified sugars.
• 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: Soluble in water at 10mg/ml
• Peso molecular: 383.780 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 9
• Exact Mass: 383.098 Da
• Monoisotopic Mass: 383.098 Da
• Topological Polar Surface Area: 140.000 Ų
• Heavy Atom Count: 25
• Formal Charge: 0
• Complexity: 506.000
• 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

Referencias

1. Gao Minghong, Li Juan, Bao Zixian, Hu Moudong, Nian Rui, Feng Dexin, An Dong, Li Xing, Xian Mo, Zhang Haibo.  (2019)  A natural in situ fabrication method of functional bacterial cellulose using a microorganism.  Nature Communications,  10  (1): (1-10).  [PMID:30683871] [10.1038/s41467-018-07879-3]