Epimedin C

Base Information

• Chemical Name: Epimedin C
• CAS No.: 110642-44-9
• Molecular Formula: C₃₉H₅₀O₁₉
• Molecular Weight: 822.815
• Hs Code.: 29329990
• DSSTox Substance ID: DTXSID90149351
• Nikkaji Number: J471.987E
• Wikidata: Q72470910
• Metabolomics Workbench ID: 143871
• Mol file: 110642-44-9.mol

Synonyms:epimedin C

Chemical Property of Epimedin C

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 179-180 °C(Solv: methanol (67-56-1))
• Refractive Index: 1.677
• Boiling Point: 1062.1 °C at 760 mmHg
• PKA: 5.90±0.40(Predicted)
• Flash Point: 322.2 °C
• PSA: 297.12000
• Density: 1.57 g/cm³
• LogP: -1.08030
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Solubility.: DMSO (Slightly), Methanol (Slightly)
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 10
• Hydrogen Bond Acceptor Count: 19
• Rotatable Bond Count: 11
• Exact Mass: 822.29462936
• Heavy Atom Count: 58
• Complexity: 1450

Purity/Quality:

Epimedin C ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=C(OC4=C(C3=O)C(=CC(=C4CC=C(C)C)OC5C(C(C(C(O5)CO)O)O)O)O)C6=CC=C(C=C6)OC)C)O)O)O)O)O
• Isomeric SMILES: C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@@H]([C@H]([C@@H](O[C@H]2OC3=C(OC4=C(C3=O)C(=CC(=C4CC=C(C)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)C6=CC=C(C=C6)OC)C)O)O)O)O)O
• Uses: Epimedin C has a potential to treat cardiovascular diseases and bone loss. A natural flavonoid extract from Epimedium sagittatum it is used as a health-promoting agent in Chinese traditional medicine.