Aureothin

Base Information

• Chemical Name: Aureothin
• CAS No.: 2825-00-5
• Molecular Formula: C22H23 N O6
• Molecular Weight: 397.46
• DSSTox Substance ID: DTXSID201043756
• Nikkaji Number: J12.863E,J2.134.921F
• Wikipedia: Aureothin
• Wikidata: Q27149169
• Metabolomics Workbench ID: 78626
• Mol file: 2825-00-5.mol

Synonyms:alloaureothin;aureothin;mycolutein

Chemical Property of Aureothin

Chemical Property:

• Vapor Pressure: 5.86E-14mmHg at 25°C
• Melting Point: 157-158℃
• Refractive Index: 1.5614 (estimate)
• Boiling Point: 591.4°Cat760mmHg
• Flash Point: 235°C
• PSA: 94.49000
• Density: 1.26g/cm³
• LogP: 5.18790
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 397.15253745
• Heavy Atom Count: 29
• Complexity: 806

Purity/Quality:

98%Min ^*data from raw suppliers

Aureothin ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(OC(=C(C1=O)C)OC)C2CC(=CC(=CC3=CC=C(C=C3)[N+](=O)[O-])C)CO2
• Isomeric SMILES: CC1=C(OC(=C(C1=O)C)OC)[C@H]2C/C(=C/C(=C/C3=CC=C(C=C3)[N+](=O)[O-])/C)/CO2
• Uses: Aureothin, an unusual pyranone metabolite, has broad biological actions including antitumour, antimicrobial and insecticidal activities. Aureothin acts by inhibiting oxidoreductase. More recently, aureothin has been shown to be a potent inhibitor of Helicobacter pylori. Aureothin, an unusual pyranone metabolite, has broad biological actions including antitumor, antimicrobial and insecticidal activities. Aureothin acts by inhibiting oxidoreductase. More recently, aureothin has been shown to be a potent inhibitor of Helicobacter pylori.