Chitooctaose hydrochloride - ≥95% , CAS No.98632-70-3

CAS: 98632-70-3 Cat. No.: C305406 Formula: C48H90N8O33·8HCl Peso molecolare: 1598.94

GRADE & PURITY ≥95%

Synonyms

N-(3,4,5,6-tetrahydroxy-1-oxohexan-2-yl)acetamide|D-Glucose, 2-(acetylamino)-2-deoxy-|98632-70-3|2-Acetamido-2-deoxyglucose|Chitooctaose octahydrochloride, 95%|D-Glucose, 2-acetamido-2-deoxy-|D-Mannose, 2-(acetyl-d3-amino)-2-deoxy-|134451-94-8|n-acetyl-l-

Storage

Room temperature

Shipped In

Normal

Specifications

Sinonimi

N-(3,4,5,6-tetrahydroxy-1-oxohexan-2-yl)acetamide | D-Glucose, 2-(acetylamino)-2-deoxy- | 98632-70-3 | 2-Acetamido-2-deoxyglucose | Chitooctaose octahydrochloride, 95% | D-Glucose, 2-acetamido-2-deoxy- | D-Mannose, 2-(acetyl-d3-amino)-2-deoxy- | 134451-94-8 | n-acetyl-l-

Specifiche e purezza

≥95%

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥95%

Nomi e identificatori

• Sorrisi canonici: CC(=O)NC(C=O)C(C(C(CO)O)O)O
• IUPAC Name: N-(3,4,5,6-tetrahydroxy-1-oxohexan-2-yl)acetamide
• InChIKey: MBLBDJOUHNCFQT-UHFFFAOYSA-N
• INCHI: 1S/C8H15NO6/c1-4(12)9-5(2-10)7(14)8(15)6(13)3-11/h2,5-8,11,13-15H,3H2,1H3,(H,9,12)
• Isomeri SMILES: CC(=O)NC(C=O)C(C(C(CO)O)O)O
• Peso molecolare: 1598.94
• Reaxy-Rn: 22143285
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=22143285&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Carbohydrates and carbohydrate conjugates
        • Level5 Monosaccharides
          • Level6 Hexoses

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Carbohydrates and carbohydrate conjugates
• Intermediate Tree Nodes: Monosaccharides
• Direct Parent: Hexoses
• Alternative Parents: Aminosaccharides Beta-hydroxy aldehydes Acetamides Secondary carboxylic acid amides Secondary alcohols Polyols Primary alcohols Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hexose monosaccharide - Amino saccharide - Beta-hydroxy aldehyde - Acetamide - Carboxamide group - Secondary alcohol - Secondary carboxylic acid amide - Carboxylic acid derivative - Polyol - Aldehyde - Organonitrogen compound - Organic oxide - Alcohol - Organopnictogen compound - Carbonyl group - Organic nitrogen compound - Primary alcohol - Hydrocarbon derivative - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as hexoses. These are monosaccharides in which the sugar unit is a is a six-carbon containing moeity.
• 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: 221.210 g/mol
• XLogP3: -3.400
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 221.09 Da
• Monoisotopic Mass: 221.09 Da
• Topological Polar Surface Area: 127.000 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 221.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 4
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1