N-Isobutyryl-L-cysteine - ≥97% , CAS No.124529-02-8

CAS: 124529-02-8 Cat. No.: N337613 Peso molecular: 191.25 Número EC: 691-989-3

GRADE & PURITY ≥97%

Synonyms

(2R)-2-(2-methylpropanamido)-3-sulfanylpropanoic acid | N-(2-Methylpropionyl)-L-cysteine | (2R)-2-(2-methylpropanoylamino)-3-sulfanylpropanoic acid | N-Isobutyryl-L-cysteine | (R)-2-Isobutyramido-3-mercaptopropanoic acid | L-Cysteine, N-(2-methyl-1-oxopro

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Descripción general

N-Isobutyryl-L-cysteine is a thiol compound, which distinguishes chirality in assays involving amino acids with OPA. N-Isobutyryl-L-cysteine is employed along with gold particles on a monolayer surface to separate single stranded DNA, via the interaction between the dipole moment of N-Isobutyryl-L-cysteine and the negative charge of single stranded DNA. These studies determined that N-Isobutyryl-L-cysteine is an essential tool along with gold nanoparticles in vibrational circular dichroism (VCD) and circular dichroism (CD) spectroscopy. Furthermore, the L isomer is more effective in adsorption of relaxed DNA compared to the D form which causes DNA to supercoil and results in a weaker binding strength.

Specifications

Sinónimos

(2R)-2-(2-methylpropanamido)-3-sulfanylpropanoic acid | N-(2-Methylpropionyl)-L-cysteine | (2R)-2-(2-methylpropanoylamino)-3-sulfanylpropanoic acid | N-Isobutyryl-L-cysteine | (R)-2-Isobutyramido-3-mercaptopropanoic acid | L-Cysteine, N-(2-methyl-1-oxopro

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: 488187806
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488187806
• Sonrisas canónicas: CC(C)C(=O)NC(CS)C(=O)O
• IUPAC Name: (2R)-2-(2-methylpropanoylamino)-3-sulfanylpropanoic acid
• InChIKey: BWBQXMAXLAHHTK-YFKPBYRVSA-N
• INCHI: 1S/C7H13NO3S/c1-4(2)6(9)8-5(3-12)7(10)11/h4-5,12H,3H2,1-2H3,(H,8,9)(H,10,11)/t5-/m0/s1
• Isómeros SMILES: CC(C)C(=O)N[C@@H](CS)C(=O)O
• Peso molecular: 191.25
• Reaxy-Rn: 25475057
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=25475057&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives
            • Level7 N-acyl-alpha amino acids and derivatives
              • Level8 N-acyl-alpha amino acids
                • Level9 N-acyl-L-alpha-amino acids

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives - N-acyl-alpha amino acids and derivatives - N-acyl-alpha amino acids
• Direct Parent: N-acyl-L-alpha-amino acids
• Alternative Parents: Cysteine and derivatives Secondary carboxylic acid amides Monocarboxylic acids and derivatives Carboxylic acids Alkylthiols Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: N-acyl-l-alpha-amino acid - Cysteine or derivatives - Carboxamide group - Secondary carboxylic acid amide - Alkylthiol - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organic oxide - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as n-acyl-l-alpha-amino acids. These are n-acylated alpha amino acids which have the L-configuration of the alpha-carbon atom.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Sensibilidad: Moisture sensitive;Air sensitive
• Punto de fusión (°C): 97-101° C
• Peso molecular: 191.250 g/mol
• XLogP3: 0.500
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 191.062 Da
• Monoisotopic Mass: 191.062 Da
• Topological Polar Surface Area: 67.400 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 181.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• 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: 1