Prodelphinidin B

Base Information

• Chemical Name: Prodelphinidin B
• CAS No.: 86631-36-9
• Molecular Formula: C30H26O14
• Molecular Weight: 610.52
• DSSTox Substance ID: DTXSID001030250
• Nikkaji Number: J2.406.955I
• Wikidata: Q105245096
• Wikipedia: Prodelphinidin_B9
• Mol file: 86631-36-9.mol

Synonyms:Prodelphinidin B;Prodelphinidin B9;86631-36-9;2-(3,4,5-trihydroxyphenyl)-8-[3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol;ProdelphinidinB4;SCHEMBL17548762;DTXSID001030250;Epigallocatechin(4a->8)epigallocatechin

Chemical Property of Prodelphinidin B

Chemical Property:

• Boiling Point: 946.8±65.0 °C(Predicted)
• Density: 1.817±0.06 g/cm3(Predicted)
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 12
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 3
• Exact Mass: 610.13225550
• Heavy Atom Count: 44
• Complexity: 965

Purity/Quality:

ProdelphinidinB9 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C(=C5)O)O)O)O)O)O)C6=CC(=C(C(=C6)O)O)O)O
• Uses: Prodelphinidin B9 is a polymeric tannin composed of Gallocatechin (G188990) and can be synthesized from (-)-Epigallocatechin Gallate (E588500), a tumor-inhibiting constituent of green tea.