Thesioideoside

Base Information

• Chemical Name: Thesioideoside
• CAS No.: 145937-28-6
• Molecular Formula: C28H32 O17
• Molecular Weight: 640.54
• DSSTox Substance ID: DTXSID40163209
• Wikidata: Q83032084
• Mol file: 145937-28-6.mol

Synonyms:thesioideoside

Chemical Property of Thesioideoside

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 1006.1°Cat760mmHg
• PKA: 6.17±0.40(Predicted)
• Flash Point: 329.2°C
• PSA: 278.66000
• Density: 1.79g/cm³
• LogP: -2.41170
• XLogP3: -0.9
• Hydrogen Bond Donor Count: 10
• Hydrogen Bond Acceptor Count: 17
• Rotatable Bond Count: 8
• Exact Mass: 640.16394955
• Heavy Atom Count: 45
• Complexity: 1060

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O)O
• Isomeric SMILES: COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O