Isopsoralenoside

Base Information

• Chemical Name: Isopsoralenoside
• CAS No.: 905954-18-9
• Molecular Formula: C17H18O9
• Molecular Weight: 366.3
• Nikkaji Number: J2.306.681E
• Wikidata: Q104951609
• Mol file: 905954-18-9.mol

Synonyms:isopsoralenoside

Chemical Property of Isopsoralenoside

Chemical Property:

• PKA: 4.19±0.40(Predicted)
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 5
• Exact Mass: 366.09508215
• Heavy Atom Count: 26
• Complexity: 524

Purity/Quality:

HPLC≥98% ^*data from raw suppliers

Isopsoralenoside(NewProduct) 98%(HPLC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC2=C(C=CO2)C(=C1C=CC(=O)O)OC3C(C(C(C(O3)CO)O)O)O
• Isomeric SMILES: C1=CC2=C(C=CO2)C(=C1/C=C\C(=O)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O