Threonyl-aspartyl-tyrosine

Base Information

• Chemical Name: Threonyl-aspartyl-tyrosine
• CAS No.: 115053-54-8
• Molecular Formula: C17H23 N3 O8
• Molecular Weight: 397.38
• DSSTox Substance ID: DTXSID80921608
• Mol file: 115053-54-8.mol

Synonyms:N-(N-L-threonyl-L-alpha-aspartyl)-L-tyrosine;SPA-S-646;Thr-Asp-Tyr;threonyl-aspartyl-tyrosine

Chemical Property of Threonyl-aspartyl-tyrosine

Chemical Property:

• Vapor Pressure: 1.1E-27mmHg at 25°C
• Boiling Point: 809.5°Cat760mmHg
• Flash Point: 443.4°C
• PSA: 227.26000
• Density: 1.496g/cm³
• LogP: 0.32300
• XLogP3: -6.6
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 10
• Exact Mass: 397.14851470
• Heavy Atom Count: 28
• Complexity: 613

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C(C(=O)C1=C(C=CC(=C1C(=O)C(CC(=O)O)N)CC(C(=O)O)N)O)N)O