Glycyl-4-aminobutyric Acid - ≥95% , CAS No.32595-49-6

CAS: 32595-49-6 Cat. No.: G300758 Molecular Weight: 160.17

GRADE & PURITY ≥95%

Synonyms

AKOS009159353 | SCHEMBL1706510 | G0115 | DTXSID80954315 | Glycyl-4-amino-n-butyric acid (gamma-) | 4-[(2-Amino-1-hydroxyethylidene)amino]butanoic acid | GLYCYL-4-AMINO-N-BUTYRIC ACID | H-Gly-gamma-Abu-OH | NSC203795 | NSC-203795 | 4-(glycylamino)butanoic

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyms

AKOS009159353 | SCHEMBL1706510 | G0115 | DTXSID80954315 | Glycyl-4-amino-n-butyric acid (gamma-) | 4-[(2-Amino-1-hydroxyethylidene)amino]butanoic acid | GLYCYL-4-AMINO-N-BUTYRIC ACID | H-Gly-gamma-Abu-OH | NSC203795 | NSC-203795 | 4-(glycylamino)butanoic

Specifications & Purity

≥95%

Storage

Protected from light, Room temperature, Argon charged

Shipped In

Normal

Purity

≥95%

Names and Identifiers

• Canonical Smiles: C(CC(=O)O)CNC(=O)CN
• IUPAC Name: 4-[(2-aminoacetyl)amino]butanoic acid
• InChIKey: FNSFAHRUVVKKMM-UHFFFAOYSA-N
• INCHI: 1S/C6H12N2O3/c7-4-5(9)8-3-1-2-6(10)11/h1-4,7H2,(H,8,9)(H,10,11)
• Isomeric SMILES: C(CC(=O)O)CNC(=O)CN
• Molecular Weight: 160.17
• Reaxy-Rn: 2436752
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2436752&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Peptidomimetics
      • Subclass Hybrid peptides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Peptidomimetics
• Subclass: Hybrid peptides
• Intermediate Tree Nodes: Not available
• Direct Parent: Hybrid peptides
• Alternative Parents: Gamma amino acids and derivatives Alpha amino acid amides Straight chain fatty acids Secondary carboxylic acid amides Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hybrid peptide - Alpha-amino acid amide - Gamma amino acid or derivatives - Alpha-amino acid or derivatives - Straight chain fatty acid - Fatty acid - Fatty acyl - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Amino acid - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Carbonyl group - Primary amine - Organic oxygen compound - Amine - Hydrocarbon derivative - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as hybrid peptides. These are compounds containing at least two different types of amino acids (alpha, beta, gamma, delta) linked to each other through a peptide bond.
• 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

• Melt Point(°C): 195 °C
• Molecular Weight: 160.170 g/mol
• XLogP3: -3.800
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 160.085 Da
• Monoisotopic Mass: 160.085 Da
• Topological Polar Surface Area: 92.400 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 147.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• 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