Vinaxanthone

Base Information

• Chemical Name: Vinaxanthone
• CAS No.: 133293-89-7
• Molecular Formula: C28H16 O14
• Molecular Weight: 576.42
• DSSTox Substance ID: DTXSID50928043
• Nikkaji Number: J2.603.983E
• Wikidata: Q77518780
• Metabolomics Workbench ID: 105266
• ChEMBL ID: CHEMBL510257
• Mol file: 133293-89-7.mol

Synonyms:411F;SM-345431;vina-xanthone;vinaxanthone

Chemical Property of Vinaxanthone

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 1064.4°Cat760mmHg
• Flash Point: 357.6°C
• PSA: 250.08000
• Density: 1.772g/cm³
• LogP: 3.34360
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 5
• Exact Mass: 576.05400518
• Heavy Atom Count: 42
• Complexity: 1240

Purity/Quality:

VINAXANTHONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1=C(C(=C2C(=C1)C(=O)C3=C(O2)C=C(C(=C3C(=O)O)O)O)C(=O)C)C4=COC5=C(C4=O)C(=C(C(=C5)O)O)C(=O)O
• Uses: Vinaxanthone is used in the pharmaceutical composition containing xanthone compound SM-?345431 for treating cerebral infarction.