Patuletin-7-diglucoside

Base Information

• Chemical Name: Patuletin-7-diglucoside
• CAS No.: 70288-92-5
• Molecular Formula: C28H32O18
• Molecular Weight: 656.5429
• DSSTox Substance ID: DTXSID60220520
• Wikidata: Q83097773

Synonyms:Patuletin-7-diglucoside;70288-92-5;7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-6-methoxychromen-4-one;DTXSID60220520;C28H32O18;C28-H32-O18;4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-7-((O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy)-3,5-dihydroxy-6-methoxy-

Chemical Property of Patuletin-7-diglucoside

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 1030.9°Cat760mmHg
• Flash Point: 336.2°C
• Density: 1.86g/cm³
• XLogP3: -1.3
• Hydrogen Bond Donor Count: 11
• Hydrogen Bond Acceptor Count: 18
• Rotatable Bond Count: 8
• Exact Mass: 656.15886417
• Heavy Atom Count: 46
• Complexity: 1090

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C2C(=C1O)C(=O)C(=C(O2)C3=CC(=C(C=C3)O)O)O)OC4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O
• Isomeric SMILES: COC1=C(C=C2C(=C1O)C(=O)C(=C(O2)C3=CC(=C(C=C3)O)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O

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