Destomycin A

Base Information

• Chemical Name: Destomycin A
• CAS No.: 14918-35-5
• Molecular Formula: C₂₀H₃₇N₃O₁₃
• Molecular Weight: 527.526
• UNII: PL7443WI4A
• DSSTox Substance ID: DTXSID201016602
• Nikkaji Number: J201.473D
• Wikidata: Q27286613
• Metabolomics Workbench ID: 69937
• Mol file: 14918-35-5.mol

Synonyms:destomycin A

Chemical Property of Destomycin A

Chemical Property:

• Melting Point: 180-190° (dec)
• Refractive Index: 1.6300 (estimate)
• Boiling Point: 897.6°Cat760mmHg
• PKA: 12.53±0.10(Predicted)
• Flash Point: 496.7°C
• PSA: 272.06000
• Density: 1.67g/cm³
• LogP: -5.47910
• XLogP3: -6.6
• Hydrogen Bond Donor Count: 11
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 6
• Exact Mass: 527.23263824
• Heavy Atom Count: 36
• Complexity: 756

Purity/Quality:

98%min ^*data from raw suppliers

DESTOMYCIN A 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CNC1CC(C(C(C1O)OC2C3C(C(C(O2)CO)O)OC4(O3)C(C(C(C(O4)C(CO)N)O)O)O)O)N
• Isomeric SMILES: CN[C@@H]1C[C@@H]([C@H]([C@@H]([C@H]1O)O[C@H]2[C@@H]3[C@H]([C@H]([C@H](O2)CO)O)OC4(O3)[C@@H]([C@H]([C@H]([C@H](O4)[C@H](CO)N)O)O)O)O)N