Talopeptin

Base Information

• Chemical Name: Talopeptin
• CAS No.: 84235-60-9
• Molecular Formula: C₂₃H₃₄N₃O₁₀P
• Molecular Weight: 543.511
• DSSTox Substance ID: DTXSID401029277
• Nikkaji Number: J133.847A
• Wikipedia: Talopeptin
• Wikidata: Q7680303
• ChEMBL ID: CHEMBL1742968
• Mol file: 84235-60-9.mol

Synonyms:N-(6-deoxy-alpha-talopyranosyloxyphospho)-leucyl-tryptophan;talopeptin;talopeptin (MKI)

Chemical Property of Talopeptin

Chemical Property:

• PKA: -0.66±0.50(Predicted)
• PSA: 223.97000
• Density: 1.48g/cm³
• LogP: 1.45980
• XLogP3: -0.2
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 11
• Exact Mass: 543.19818129
• Heavy Atom Count: 37
• Complexity: 848

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(C(C(C(O1)OP(=O)(NC(CC(C)C)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O)O)O)O)O
• Isomeric SMILES: C[C@H]1[C@H]([C@H]([C@H]([C@@H](O1)OP(=O)(N[C@@H](CC(C)C)C(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)O)O)O)O)O