Prodelphiniline

Base Information

• Chemical Name: Prodelphiniline
• CAS No.: 20136-67-8
• Molecular Formula: C30H26O14
• Molecular Weight: 610.519
• NSC Number: 143101
• DSSTox Substance ID: DTXSID10942169
• Wikidata: Q82919140
• ChEMBL ID: CHEMBL1996865
• Mol file: 20136-67-8.mol

Synonyms:Prodelphiniline;NSC143101;20136-67-8;NSC 143101;2-((2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl)oxy)-2-(3,4,5-trihydroxyphenyl)chromane-3,4,5,7-tetrol;Prodelphinidine;NSC-143101;2-{[2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl]oxy}-2-(3,4,5-trihydroxyphenyl)chromane-3,4,5,7-tetrol;2-((2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl)oxy)-2-(3,4,5-trihydroxyphenyl)-3,4,5,7-chromanetetrol;CHEMBL1996865;SCHEMBL13772048;DTXSID10942169;2-[[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl]oxy]-2-(3,4,5-trihydroxyphenyl)-3,4-dihydrochromene-3,4,5,7-tetrol;NCI60_000947;2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-chroman-3-yl]oxy-2-(3,4,5-trihydroxyphenyl)chromane-3,4,5,7-tetrol;2-{[2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,4,5,7-tetrol

Chemical Property of Prodelphiniline

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 988.5°C at 760 mmHg
• Flash Point: 551.6°C
• Density: 1.94g/cm³
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 11
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 4
• Exact Mass: 610.13225550
• Heavy Atom Count: 44
• Complexity: 977

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC4(C(C(C5=C(C=C(C=C5O4)O)O)O)O)C6=CC(=C(C(=C6)O)O)O