Wilfoside C 1N

Base Information

• Chemical Name: Wilfoside C 1N
• CAS No.: 96829-53-7
• Molecular Formula: C56H90O19
• Molecular Weight: 1067.3024
• Mol file: 96829-53-7.mol

Synonyms:Wilfoside C 1N;96829-53-7;Pregn-5-en-20-one, 3-((O-2,6-dideoxy-3-O-methyl-alpha-L-ribo-hexopyranosyl-(1-4)-O-2,6-dideoxy-3-O-methyl-beta-D-ribo-hexopyranosyl-(1-4)-O-2,6-dideoxy-3-O-methyl-alpha-L-lyxo-hexopyranosyl-(1-4)-2,6-dideoxy-3-O-methyl-beta-D-ribo-hexopyranosyl)oxy)-12-(((2E)-3,4-dimethyl-1-oxo-2-pentenyl)oxy)-8,14,17-trihydroxy-, (3beta,12beta,14beta,17alpha)-;C56H90O19;C56-H90-O19

Chemical Property of Wilfoside C 1N

Chemical Property:

• Boiling Point: 979.5°Cat760mmHg
• Flash Point: 261.9°C
• Density: 1.26g/cm³
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 19
• Rotatable Bond Count: 18
• Exact Mass: 1066.60763064
• Heavy Atom Count: 75
• Complexity: 2050

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(=CC(=O)OC1CC2C3(CCC(CC3=CCC2(C4(C1(C(CC4)(C(=O)C)O)C)O)O)OC5CC(C(C(O5)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)OC8CC(C(C(O8)C)O)OC)OC)OC)OC)C)C
• Isomeric SMILES: CCC/C(=C/C(=O)OC1CC2C3(CCC(CC3=CCC2(C4(C1(C(CC4)(C(=O)C)O)C)O)O)OC5CC(C(C(O5)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)OC8CC(C(C(O8)C)O)OC)OC)OC)OC)C)/C