Pro-Gln-OH - ≥98% , CAS No.18668-08-1

CAS: 18668-08-1 Cat. No.: P381971 Fórmula: C₁₀H₁₇N₃O₄ Peso molecular: 243.26 PubChem CID: 7408110

GRADE & PURITY ≥98%

Synonyms

DTXSID50428578 | Prolyl-Glutamine | (S)-5-Amino-5-oxo-2-((S)-pyrrolidine-2-carboxamido)pentanoic acid | CHEBI:74757 | MFCD00037873 | (2S)-5-amino-5-oxo-2-[[(2S)-pyrrolidin-1-ium-2-carbonyl]amino]pentanoate | (2S)-5-amino-5-oxo-2-[[(2S)-pyrrolidine-2-carbo

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

DTXSID50428578 | Prolyl-Glutamine | (S)-5-Amino-5-oxo-2-((S)-pyrrolidine-2-carboxamido)pentanoic acid | CHEBI:74757 | MFCD00037873 | (2S)-5-amino-5-oxo-2-[[(2S)-pyrrolidin-1-ium-2-carbonyl]amino]pentanoate | (2S)-5-amino-5-oxo-2-[[(2S)-pyrrolidine-2-carbo

Especificaciones y pureza

≥98%

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

≥98%

Nombres e identificadores

• Pubchem Sid: 504764753
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504764753
• Sonrisas canónicas: C1CC(NC1)C(=O)NC(CCC(=O)N)C(=O)O
• IUPAC Name: (2S)-5-amino-5-oxo-2-[[(2S)-pyrrolidine-2-carbonyl]amino]pentanoic acid
• InChIKey: SHAQGFGGJSLLHE-BQBZGAKWSA-N
• INCHI: 1S/C10H17N3O4/c11-8(14)4-3-7(10(16)17)13-9(15)6-2-1-5-12-6/h6-7,12H,1-5H2,(H2,11,14)(H,13,15)(H,16,17)/t6-,7-/m0/s1
• Isómeros SMILES: C1C[C@H](NC1)C(=O)N[C@@H](CCC(=O)N)C(=O)O
• PubChem CID: 7408110
• Peso molecular: 243.26

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Peptides
          • Level6 Dipeptides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Peptides
• Direct Parent: Dipeptides
• Alternative Parents: Glutamine and derivatives Proline and derivatives Alpha amino acid amides N-acyl-L-glutamines Pyrrolidinecarboxamides Heterocyclic fatty acids Fatty amides Secondary carboxylic acid amides Primary carboxylic acid amides Amino acids Carboxylic acid salts Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Dialkylamines Hydrocarbon derivatives Organic oxides Carbonyl compounds Organic salts Organic zwitterions Organopnictogen compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Alpha-dipeptide - Glutamine or derivatives - Proline or derivatives - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - N-acyl-l-alpha-amino acid - Alpha-amino acid amide - N-acyl-l-glutamine - Alpha-amino acid or derivatives - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Heterocyclic fatty acid - Fatty amide - Fatty acyl - Fatty acid - Pyrrolidine - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid salt - Amino acid - Primary carboxylic acid amide - Secondary amine - Carboxylic acid - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organic salt - Amine - Organic zwitterion - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Carbonyl group - Aliphatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.
• External Descriptors: dipeptide

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

Mecanismos de acción

Propiedades químicas y físicas

• Peso molecular: 243.260 g/mol
• XLogP3: -4.900
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 243.122 Da
• Monoisotopic Mass: 243.122 Da
• Topological Polar Surface Area: 122.000 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 319.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• 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