Veratriloside

Base Information

• Chemical Name: Veratriloside
• CAS No.: 76907-78-3
• Molecular Formula: C21H22 O11
• Molecular Weight: 450.39278
• DSSTox Substance ID: DTXSID30227708
• Wikidata: Q83107523
• Metabolomics Workbench ID: 137094
• ChEMBL ID: CHEMBL468010
• Mol file: 76907-78-3.mol

Synonyms:1-hydroxy-7-O-beta-D-glucopyranosyl-3,4-dimethoxy-xanthone;veratriloside

Chemical Property of Veratriloside

Chemical Property:

• Vapor Pressure: 1.07E-25mmHg at 25°C
• Boiling Point: 781.2°C at 760 mmHg
• Flash Point: 275.8°C
• PSA: 168.28000
• Density: 1.568g/cm³
• LogP: -0.15230
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 5
• Exact Mass: 450.11621151
• Heavy Atom Count: 32
• Complexity: 662

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C2=C(C(=C1)O)C(=O)C3=C(O2)C=CC(=C3)OC4C(C(C(C(O4)CO)O)O)O)OC
• Isomeric SMILES: COC1=C(C2=C(C(=C1)O)C(=O)C3=C(O2)C=CC(=C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)OC