Glycyl-alpha-aspartylphenylalanyl-alpha-glutamyl-alpha-glutamylisoleucylprolyl-alpha-glutamyl-alpha-glutamyltyrosylleucylglutamine

Base Information

• Chemical Name: Glycyl-alpha-aspartylphenylalanyl-alpha-glutamyl-alpha-glutamylisoleucylprolyl-alpha-glutamyl-alpha-glutamyltyrosylleucylglutamine
• CAS No.: 113274-56-9
• Molecular Formula: C66H93N13O25
• Molecular Weight: 1468.52
• DSSTox Substance ID: DTXSID60583167
• Mol file: 113274-56-9.mol

Synonyms:113274-56-9;Hirudin(54-65)(desulfated);DTXSID60583167;Glycyl-alpha-aspartylphenylalanyl-alpha-glutamyl-alpha-glutamylisoleucylprolyl-alpha-glutamyl-alpha-glutamyltyrosylleucylglutamine

Chemical Property of Glycyl-alpha-aspartylphenylalanyl-alpha-glutamyl-alpha-glutamylisoleucylprolyl-alpha-glutamyl-alpha-glutamyltyrosylleucylglutamine

Chemical Property:

• Boiling Point: 1913.6±65.0 °C(Predicted)
• PKA: 3.25±0.10(Predicted)
• PSA: 624.45000
• Density: 1.384±0.06 g/cm3(Predicted)
• LogP: 1.59880
• Storage Temp.: −20°C
• XLogP3: -4.5
• Hydrogen Bond Donor Count: 19
• Hydrogen Bond Acceptor Count: 26
• Rotatable Bond Count: 47
• Exact Mass: 1467.64055550
• Heavy Atom Count: 104
• Complexity: 3050

Purity/Quality:

99%, ^*data from raw suppliers

Hirudin ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)C(C(=O)N1CCCC1C(=O)NC(CCC(=O)O)C(=O)NC(CCC(=O)O)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)NC(CC(C)C)C(=O)NC(CCC(=O)N)C(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(CC3=CC=CC=C3)NC(=O)C(CC(=O)O)NC(=O)CN
• Uses: Hirudin is a small protein (polypeptide) composed of 65-66 amino acids. Hirudin has a strong inhibitory effect on thrombin and is the strongest natural specific inhibitor of thrombin found so far.