Medermycin

Base Information

• Chemical Name: Medermycin
• CAS No.: 60227-09-0
• Molecular Formula: C24H27 N O8
• Molecular Weight: 457.47
• ChEMBL ID: CHEMBL2216825
• DSSTox Substance ID: DTXSID601318319
• Metabolomics Workbench ID: 70945,98137
• Nikkaji Number: J139.431B
• Pharos Ligand ID: 3KCS6XUCX2UJ
• Wikidata: Q27114688
• Mol file: 60227-09-0.mol

Synonyms:lactoquinomycin;medermycin

Chemical Property of Medermycin

Chemical Property:

• Vapor Pressure: 1.22E-20mmHg at 25°C
• Boiling Point: 701.2°C at 760 mmHg
• Flash Point: 377.9°C
• PSA: 122.60000
• Density: 1.38g/cm³
• LogP: 1.31160
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 2
• Exact Mass: 457.17366682
• Heavy Atom Count: 33
• Complexity: 899

Purity/Quality:

99%, ^*data from raw suppliers

MEDERMYCIN 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(C(CC(O1)C2=C(C3=C(C=C2)C(=O)C4=C(C3=O)C(OC5C4OC(=O)C5)C)O)N(C)C)O
• Isomeric SMILES: C[C@@H]1[C@H]([C@@H](C[C@@H](O1)C2=C(C3=C(C=C2)C(=O)C4=C(C3=O)[C@H](O[C@H]5[C@@H]4OC(=O)C5)C)O)N(C)C)O