(R)-2-(((Benzyloxy)carbonyl)amino)-3,3-dimethylbutanoic acid , CAS No.70874-05-4

CAS: 70874-05-4 Cat. No.: C647492 Peso molecular: 265.3

Synonyms

(R)-2-(benzyloxycarbonylamino)-3,3-dimethylbutanoic acid | (2R)-3,3-dimethyl-2-(phenylmethoxycarbonylamino)butanoic acid | DTXSID70448637 | PD196080 | CBZL-D-TERT-LEUCINE | Cbz-D-tert-leucine | (R)-2-(CBZ-AMINO)-3,3-DIMETHYLBUTANOIC ACID | N-[(Benzyloxy)c

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Descripción general

(R)-2-(((Benzyloxy)carbonyl)amino)-3,3-dimethylbutanoic acid is a leucine derivative.

In Vitro

Amino acids and amino acid derivatives have been commercially used as ergogenic supplements. They influence the secretion of anabolic hormones, supply of fuel during exercise, mental performance during stress related tasks and prevent exercise induced muscle damage. They are recognized to be beneficial as ergogenic dietary substances. MCE has not independently confirmed the accuracy of these methods. They are for reference only.

Form:Liquid

Specifications

Sinónimos

(R)-2-(benzyloxycarbonylamino)-3, 3-dimethylbutanoic acid | (2R)-3, 3-dimethyl-2-(phenylmethoxycarbonylamino)butanoic acid | DTXSID70448637 | PD196080 | CBZL-D-TERT-LEUCINE | Cbz-D-tert-leucine | (R)-2-(CBZ-AMINO)-3, 3-DIMETHYLBUTANOIC ACID | N-[(Benzyloxy)c

Mecanismos bioquímicos y fisiológicos

(R)-2-(((Benzyloxy)carbonyl)amino)-3, 3-dimethylbutanoic acid is a leucine derivative.

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.

Nombres e identificadores

• Sonrisas canónicas: CC(C)(C)C(C(=O)O)NC(=O)OCC1=CC=CC=C1
• IUPAC Name: (2R)-3,3-dimethyl-2-(phenylmethoxycarbonylamino)butanoic acid
• InChIKey: NSVNKQLSGGKNKB-NSHDSACASA-N
• INCHI: 1S/C14H19NO4/c1-14(2,3)11(12(16)17)15-13(18)19-9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m0/s1
• Isómeros SMILES: CC(C)(C)[C@H](C(=O)O)NC(=O)OCC1=CC=CC=C1
• Peso molecular: 265.3
• Reaxy-Rn: 3211036
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3211036&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 Valine and derivatives

• 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
• Direct Parent: Valine and derivatives
• Alternative Parents: Benzyloxycarbonyls Carbamate esters Monocarboxylic acids and derivatives Carboxylic acids Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Valine or derivatives - Benzyloxycarbonyl - Benzenoid - Monocyclic benzene moiety - Carbamic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as valine and derivatives. These are compounds containing valine or a derivative thereof resulting from reaction of valine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
• 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: DMSO : 100 mg/mL (376.93 mM; Need ultrasonic)
• Peso molecular: 265.300 g/mol
• XLogP3: 2.800
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 265.131 Da
• Monoisotopic Mass: 265.131 Da
• Topological Polar Surface Area: 75.600 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 316.000
• 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