5-Methoxydihydrosterigmatocystin

Base Information

• Chemical Name: 5-Methoxydihydrosterigmatocystin
• CAS No.: 101489-25-2
• Molecular Formula: C19H16 O7
• Molecular Weight: 356.35
• DSSTox Substance ID: DTXSID00906215
• Wikidata: Q82874891
• Metabolomics Workbench ID: 162323
• Mol file: 101489-25-2.mol

Synonyms:5-Methoxydihydrosterigmatocystin;CCRIS 3226;101489-25-2;7H-Furo(3',2':4,5)furo(2,3-c)xanthen-7-one, 1,2,3a,12c-tetrahydro-6,11-dimethoxy-8-hydroxy-, (3aR-cis)-;DTXSID00906215;LS-70776;8-Hydroxy-6,11-dimethoxy-1,2,3a,12c-tetrahydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one

Chemical Property of 5-Methoxydihydrosterigmatocystin

Chemical Property:

• Refractive Index: 1.4800 (estimate)
• Boiling Point: 409.17°C (rough estimate)
• Flash Point: 226.8oC
• PSA: 87.36000
• Density: 1.2878 (rough estimate)
• LogP: 2.89140
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 356.08960285
• Heavy Atom Count: 26
• Complexity: 568

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C2C(=C(C=C1)O)C(=O)C3=C(C=C4C(=C3O2)C5CCOC5O4)OC