L-Glutamic acid γ-(4-methoxy-β-naphthylamide) , CAS No.24723-50-0

CAS: 24723-50-0 Cat. No.: S168999 Summenformel: C₁₆H₁₈N₂O₄ Molekulargewicht: 302.33 EG-Nummer: 636-729-1 PubChem CID: 4060966

Synonyms

(2S)-2-amino-5-[(4-methoxynaphthalen-2-yl)amino]-5-oxopentanoic acid | 2-amino-5-[(4-methoxynaphthalen-2-yl)amino]-5-oxopentanoic acid | L-Glutamic acid gamma -(4-methoxy- beta -naphthylamide) | L-Glutamic acid gamma-(4-methoxy-beta-naphthylamide) | (2S)-

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Spezifikationen

Synonyme

(2S)-2-amino-5-[(4-methoxynaphthalen-2-yl)amino]-5-oxopentanoic acid | 2-amino-5-[(4-methoxynaphthalen-2-yl)amino]-5-oxopentanoic acid | L-Glutamic acid gamma -(4-methoxy- beta -naphthylamide) | L-Glutamic acid gamma-(4-methoxy-beta-naphthylamide) | (2S)-

Storage

Store at -20°C

Verschickt in

Ice chest + Ice pads

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Namen und Kennungen

Kanonisches Lächeln

COC1=CC(=CC2=CC=CC=C21)NC(=O)CCC(C(=O)O)N

IUPAC Name

2-amino-5-[(4-methoxynaphthalen-2-yl)amino]-5-oxopentanoic acid

InChIKey

DUNDTSUHZJULAX-UHFFFAOYSA-N

INCHI

1S/C16H18N2O4/c1-22-14-9-11(8-10-4-2-3-5-12(10)14)18-15(19)7-6-13(17)16(20)21/h2-5,8-9,13H,6-7,17H2,1H3,(H,18,19)(H,20,21)

Isomere SMILES

COC1=CC(=CC2=CC=CC=C21)NC(=O)CCC(C(=O)O)N

PubChem CID

4060966

Molekulargewicht

302.33

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Klasse Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Ebene5 Amino acids and derivatives
          • Ebene6 Alpha amino acids and derivatives
            • Ebene7 Glutamine and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: 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: Naphthalenes Alpha amino acids Methoxyanilines N-arylamides Anisoles Alkyl aryl ethers Fatty amides Secondary carboxylic acid amides Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Glutamine or derivatives - Alpha-amino acid - Naphthalene - Methoxyaniline - Anisole - N-arylamide - Phenol ether - Alkyl aryl ether - Fatty acyl - Benzenoid - Fatty amide - Amino acid - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Primary aliphatic amine - Primary amine - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Amine - Organooxygen compound - Organonitrogen compound - Aromatic homopolycyclic compound
• Beschreibung: 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

Chemische und physikalische Eigenschaften

• Molekulargewicht: 302.320 g/mol
• XLogP3: -1.000
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 302.127 Da
• Monoisotopic Mass: 302.127 Da
• Topological Polar Surface Area: 102.000 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 402.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1