Pyrroxamycin

Base Information

• Chemical Name: Pyrroxamycin
• CAS No.: 105888-54-8
• Molecular Formula: C12H6 Cl4 N2 O4
• Molecular Weight: 384.001
• Hs Code.: 2934999090
• NSC Number: 619798
• UNII: V9AXN5H81T
• DSSTox Substance ID: DTXSID601140134
• Nikkaji Number: J134.057C
• Wikidata: Q27291695
• Metabolomics Workbench ID: 98464
• Mol file: 105888-54-8.mol

Synonyms:4,5-dichloro-2-(6',8'-dichloro-4'H-1',3'-benzodioxin-4'-yl)-3-nitropyrrole;dioxapyrrolomycin;LL F 42248alpha;LL-F-42248alpha;pyrroxamycin

Chemical Property of Pyrroxamycin

Chemical Property:

• Vapor Pressure: 6.04E-10mmHg at 25°C
• Boiling Point: 508.2°Cat760mmHg
• Flash Point: 261.1°C
• PSA: 80.07000
• Density: 1.741g/cm³
• LogP: 5.51560
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 383.905217
• Heavy Atom Count: 22
• Complexity: 440

Purity/Quality:

PYRROXAMYCIN 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1OC(C2=C(O1)C(=CC(=C2)Cl)Cl)C3=C(C(=C(N3)Cl)Cl)[N+](=O)[O-]
• Isomeric SMILES: C1O[C@@H](C2=C(O1)C(=CC(=C2)Cl)Cl)C3=C(C(=C(N3)Cl)Cl)[N+](=O)[O-]
• Description: Dioxapyrrolomycin, a tricyclic pyrrole-containing antibiotic isolated first from Streptomyces fumanus Sveshnikova in the mid-1980s, displays moderate insecticidal and acaricidal activity, but systematic structural changes led to novel synthetic pyrrole derivatives with increased insecticidal activity and mammalian safety (40). The natural product and its synthetic congeners are uncouplers of mitochondrial oxidative phosphorylation.