19-Deformyl-5-O-desosaminyl tylonide

Base Information

• Chemical Name: 19-Deformyl-5-O-desosaminyl tylonide
• CAS No.: 86131-94-4
• Molecular Formula: C30H51NO8
• Molecular Weight: 553.7278
• Mol file: 86131-94-4.mol

Synonyms:19-deformyl-5-O-desosaminyl tylonide;19-DFDAT

Chemical Property of 19-Deformyl-5-O-desosaminyl tylonide

Chemical Property:

• Vapor Pressure: 3.52E-24mmHg at 25°C
• Boiling Point: 723.6°Cat760mmHg
• PKA: 13.49±0.70(Predicted)
• Flash Point: 391.4°C
• Density: 1.14g/cm³
• XLogP3: 3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 5
• Exact Mass: 553.36146759
• Heavy Atom Count: 39
• Complexity: 858

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCC1C(C=C(C=CC(=O)C(CC(C(C(C(CC(=O)O1)O)C)OC2C(C(CC(O2)C)N(C)C)O)C)C)C)CO
• Isomeric SMILES: CCC1C(/C=C(\C=C\C(=O)C(CC(C(C(C(CC(=O)O1)O)C)O[C@H]2[C@@H]([C@H](C[C@H](O2)C)N(C)C)O)C)C)/C)CO