γ-Glutamyl-β-naphthylamide - Moligand™,≥95% , CAS No.14525-44-1

CAS: 14525-44-1 Cat. No.: B301152 Molecular Weight: 272.30 EC Number: 238-542-7

GRADE & PURITY Moligand™, ≥95%

Synonyms

GAMMA-L-GLUTAMYL-BETA-NAPHTHYLAMIDE | L-Glutamine,N-2-naphthalenyl- | N-(gamma-L-glutamyl)-2-naphthylamine | N-naphthalen-2-yl-L-glutamine | FD21469 | N-(2-naphthyl)-L-glutamine | N-(beta-naphthyl)-L-glutamine | A884637 | L-glutamic acid gamma-2-naphthyla

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonyms

GAMMA-L-GLUTAMYL-BETA-NAPHTHYLAMIDE | L-Glutamine, N-2-naphthalenyl- | N-(gamma-L-glutamyl)-2-naphthylamine | N-naphthalen-2-yl-L-glutamine | FD21469 | N-(2-naphthyl)-L-glutamine | N-(beta-naphthyl)-L-glutamine | A884637 | L-glutamic acid gamma-2-naphthyla

Specifications & Purity

Moligand™, ≥95%

Storage

Store at 2-8°C

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Grade

Moligand™

Purity

≥95%

Names and Identifiers

• Canonical Smiles: C1=CC=C2C=C(C=CC2=C1)NC(=O)CCC(C(=O)O)N
• IUPAC Name: (2S)-2-amino-5-(naphthalen-2-ylamino)-5-oxopentanoic acid
• InChIKey: XWCSDVVHAXLZNL-ZDUSSCGKSA-N
• INCHI: 1S/C15H16N2O3/c16-13(15(19)20)7-8-14(18)17-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9,13H,7-8,16H2,(H,17,18)(H,19,20)/t13-/m0/s1
• Isomeric SMILES: C1=CC=C2C=C(C=CC2=C1)NC(=O)CC[C@@H](C(=O)O)N
• WGK Germany: 3
• Molecular Weight: 272.30
• Reaxy-Rn: 2754583
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2754583&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives
            • Level7 Glutamine and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives
• Direct Parent: Glutamine and derivatives
• Alternative Parents: L-alpha-amino acids Naphthalenes N-arylamides Fatty amides Secondary carboxylic acid amides Amino acids Carboxylic acid salts Carboxylic acids Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Organic salts Organopnictogen compounds Organic zwitterions Monoalkylamines Carbonyl compounds
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Glutamine or derivatives - Alpha-amino acid - Naphthalene - L-alpha-amino acid - N-arylamide - Fatty amide - Benzenoid - Fatty acyl - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - Amino acid - Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxide - Primary amine - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Primary aliphatic amine - Organic oxygen compound - Amine - Organic nitrogen compound - Organic zwitterion - Carbonyl group - Organic salt - Hydrocarbon derivative - Aromatic homopolycyclic compound
• Description: This compound belongs to the class of organic compounds known as glutamine and derivatives. These are compounds containing glutamine or a derivative thereof resulting from reaction of glutamine 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

Mechanisms of Action

Chemical and Physical Properties

• Molecular Weight: 272.300 g/mol
• XLogP3: -1.000
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 272.116 Da
• Monoisotopic Mass: 272.116 Da
• Topological Polar Surface Area: 92.400 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 359.000
• 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