4-O-Methyl-6-deoxyoxaunomycin

Base Information

• Chemical Name: 4-O-Methyl-6-deoxyoxaunomycin
• CAS No.: 146565-64-2
• Molecular Formula: C27H31 N O9
• Molecular Weight: 513.54
• DSSTox Substance ID: DTXSID00932857
• Mol file: 146565-64-2.mol

Synonyms:4-O-methyl-6-deoxyoxaunomycin;7-O-daunosaminyl-alpha-citromycinone

Chemical Property of 4-O-Methyl-6-deoxyoxaunomycin

Chemical Property:

• Vapor Pressure: 4.1E-25mmHg at 25°C
• Boiling Point: 772.6°Cat760mmHg
• Flash Point: 421°C
• PSA: 168.77000
• Density: 1.49g/cm³
• LogP: 2.33550
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 4
• Exact Mass: 513.19988157
• Heavy Atom Count: 37
• Complexity: 886

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1(CC(C2=CC3=C(C(=C2C1O)O)C(=O)C4=C(C3=O)C(=CC=C4)OC)OC5CC(C(C(O5)C)O)N)O