S-(2-Carboxietil)-L-cisteína - ≥98.0% , CAS No.4033-46-9

CAS: 4033-46-9 Cat. No.: S161421 Peso molecular: 193.22 Número EC: 223-717-2 PubChem CID: 23618202

GRADE & PURITY ≥98.0%

Synonyms

S-(2-Carboxietil)cisteína | Ácido (2R)-2-amino-3-[(2-carboxietilsulfanil)propanoico | L-cisteína, ácido S-(2-carboxietil)- | Ácido (2R)-2-amino-3-[(2-carboxietil)sulfanil]propanoico | Ácido (2R)-2-amino-3-[(2-carboxietil)sulfanil]-propanoico | S-(2-Carbox

Storage

Conservar a 2-8°C

Shipped In

Hielo húmedo

Descripción general

La S-(2-Carboxietil)-L-cisteína (S-Carboxietilcisteína) es un aminoácido azufrado no proteico (modificado). La S-(2-Carboxietil)-L-cisteína está presente en la semilla de Acacia. La S-(2-Carboxietil)-L-cisteína puede afectar al aprovechamiento proteico de la semilla en ratas. La S-(2-Carboxietil)-L-cisteína suprime la tasa de crecimiento inducida por la metionina y tiene un efecto negativo sobre los niveles plasmáticos de aminoácidos en ratas

Specifications

Sinónimos

S-(2-Carboxietil)cisteína | Ácido (2R)-2-amino-3-[(2-carboxietilsulfanil)propanoico | L-cisteína, ácido S-(2-carboxietil)- | Ácido (2R)-2-amino-3-[(2-carboxietil)sulfanil]propanoico | Ácido (2R)-2-amino-3-[(2-carboxietil)sulfanil]-propanoico | S-(2-Carbox

Especificaciones y pureza

≥98.0%

Condiciones de almacenamiento de almacenamiento

Conservar a 2-8°C

Enviado en

Hielo húmedo

Pureza

≥98.0%

Nombres e identificadores

• Sonrisas canónicas: C(CSCC(C(=O)O)N)C(=O)O
• IUPAC Name: (2R)-2-amino-3-(2-carboxyethylsulfanyl)propanoic acid
• InChIKey: FBPINGSGHKXIQA-BYPYZUCNSA-N
• INCHI: 1S/C6H11NO4S/c7-4(6(10)11)3-12-2-1-5(8)9/h4H,1-3,7H2,(H,8,9)(H,10,11)/t4-/m0/s1
• Isómeros SMILES: C(CSC[C@@H](C(=O)O)N)C(=O)O
• RTECS: AY4300000
• PubChem CID: 23618202
• Peso molecular: 193.22
• Reaxy-Rn: 1725406

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 Cysteine and derivatives
              • Level8 L-cysteine-S-conjugates

• 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 - Cysteine and derivatives
• Direct Parent: L-cysteine-S-conjugates
• Alternative Parents: L-alpha-amino acids Dicarboxylic acids and derivatives Amino acids Sulfenyl compounds Dialkylthioethers Carboxylic acids Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: L-cysteine-s-conjugate - Alpha-amino acid - L-alpha-amino acid - Dicarboxylic acid or derivatives - Amino acid - Carboxylic acid - Thioether - Dialkylthioether - Sulfenyl compound - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic oxide - Organic oxygen compound - Carbonyl group - Amine - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as l-cysteine-s-conjugates. These are compounds containing L-cysteine where the thio-group is conjugated.
• 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

• Rotación específica [α]: -10° (C=2,1mol/L Hcl)
• Punto de fusión (°C): 198 °C(dec.)
• Peso molecular: 193.220 g/mol
• XLogP3: -3.200
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 193.041 Da
• Monoisotopic Mass: 193.041 Da
• Topological Polar Surface Area: 126.000 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 173.000
• 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