Rosinidin

Base Information

• Chemical Name: Rosinidin
• CAS No.: 4092-64-2
• Molecular Formula: C17H15 O6 . Cl
• Molecular Weight: 320.727
• Hs Code.: 2909499000
• DSSTox Substance ID: DTXSID80331627
• Nikkaji Number: J2.682.786H
• Wikipedia: Rosinidin
• Wikidata: Q6112585
• Metabolomics Workbench ID: 21797
• Mol file: 4092-64-2.mol

Synonyms:Rosinidin;4092-64-2;C08729;CHEBI:8893;DTXSID80331627;2-(4-hydroxy-3-methoxyphenyl)-7-methoxychromenylium-3,5-diol;LMPK12010417;Q6112585;3,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-1-benzopyran-1-ium

Chemical Property of Rosinidin

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 100.13000
• Density: g/cm³
• LogP: 2.70250
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 315.08686319
• Heavy Atom Count: 23
• Complexity: 391

Purity/Quality:

98% ^*data from raw suppliers

Rosinidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=C2C=C(C(=[O+]C2=C1)C3=CC(=C(C=C3)O)OC)O)O
• Uses: Rosinidine is a known substituent of anthocyanins. It is being studied as a substituent for hDHFR, a potential cancer drug.