(2S)-N-2-Naphthalenyl-5-Oxo-2-Pyrrolidinecarboxamide - ≥97% , CAS No.22155-91-5

CAS: 22155-91-5 Cat. No.: L754987 Peso molecular: 254.28 Beilstein Registry Number: 5066652 Número EC: 244-809-9

GRADE & PURITY ≥97%

Synonyms

L-Pyroglutamic acid 2-naphthylamide | L-Pyroglutamic acid β-naphthylamide | L-Pyrrolidonyl-β-naphthylamide | N1-(2-Naphthyl)-L-pyroglutamic acid | PYR | N-(2-Naphthyl)-5-Oxo-Pyrrolidine-2-Carboxamide | N-(2-Naphthyl)-5-Oxo-2-Pyrrolidinecarboxamide | 5-Ket

Storage

Store at 2-8°C

Shipped In

Wet ice

Descripción general

A substrate for pyroglutamate aminopeptidase.Used for differentiation of Group A streptococci and enterococci from other streptococci.

Specifications

Sinónimos

L-Pyroglutamic acid 2-naphthylamide | L-Pyroglutamic acid β-naphthylamide | L-Pyrrolidonyl-β-naphthylamide | N1-(2-Naphthyl)-L-pyroglutamic acid | PYR | N-(2-Naphthyl)-5-Oxo-Pyrrolidine-2-Carboxamide | N-(2-Naphthyl)-5-Oxo-2-Pyrrolidinecarboxamide | 5-Ket

Especificaciones y pureza

≥97%

Mecanismos bioquímicos y fisiológicos

Pyroglutamic acid is known to participate in the gamma-glutamyl cycle. Recent studies show that a congenital metabolic error was associated with increased pyroglutamic excretion in urine.

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

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

• Sonrisas canónicas: O=C1CC[C@H](N1)C(=O)Nc2ccc3ccccc3c2
• IUPAC Name: (2S)-N-naphthalen-2-yl-5-oxopyrrolidine-2-carboxamide
• InChIKey: BZEPQNMASTUAMY-ZDUSSCGKSA-N
• INCHI: 1S/C15H14N2O2/c18-14-8-7-13(17-14)15(19)16-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9,13H,7-8H2,(H,16,19)(H,17,18)/t13-/m0/s1
• Isómeros SMILES: C1CC(=O)N[C@@H]1C(=O)NC2=CC3=CC=CC=C3C=C2
• WGK Alemania: 3
• Número ONU: 3077
• Grupo de embalaje: III
• Peso molecular: 254.28
• Beilstein: 5066652

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 Proline 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: Proline and derivatives
• Alternative Parents: Alpha amino acid amides Naphthalenes Pyrrolidinecarboxamides N-arylamides Pyrrolidine-2-ones Secondary carboxylic acid amides Lactams Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Proline or derivatives - Alpha-amino acid amide - Naphthalene - Pyrrolidine carboxylic acid or derivatives - N-arylamide - Pyrrolidine-2-carboxamide - Benzenoid - 2-pyrrolidone - Pyrrolidone - Pyrrolidine - Carboxamide group - Lactam - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as proline and derivatives. These are compounds containing proline or a derivative thereof resulting from reaction of proline 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

• Peso molecular: 254.280 g/mol
• XLogP3: 1.800
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 254.106 Da
• Monoisotopic Mass: 254.106 Da
• Topological Polar Surface Area: 58.200 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 369.000
• 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