ChemSpider 2D Image | Dieckol | C36H22O18


  • Molecular FormulaC36H22O18
  • Average mass742.549 Da
  • Monoisotopic mass742.080627 Da
  • ChemSpider ID2278311

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4-(4-{[6-(3,5-Dihydroxyphenoxy)-4,7,9-trihydroxy-2-oxanthrenyl]oxy}-3,5-dihydroxyphenoxy)-1,3,6,8-oxanthrenetetrol [ACD/IUPAC Name]
4-(4-{[6-(3,5-Dihydroxyphénoxy)-4,7,9-trihydroxy-2-oxanthrényl]oxy}-3,5-dihydroxyphénoxy)-1,3,6,8-oxanthrènetétrol [French] [ACD/IUPAC Name]
4-(4-{[6-(3,5-Dihydroxyphenoxy)-4,7,9-trihydroxy-2-oxanthrenyl]oxy}-3,5-dihydroxyphenoxy)-1,3,6,8-oxanthrentetrol [German] [ACD/IUPAC Name]
88095-77-6 [RN]
Dibenzo[b,e][1,4]dioxin-1,3,6,8-tetrol, 4-[4-[[6-(3,5-dihydroxyphenoxy)-4,7,9-trihydroxydibenzo[b,e][1,4]dioxin-2-yl]oxy]-3,5-dihydroxyphenoxy]- [ACD/Index Name]
Dieckol [Wiki]

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

AIDS209853 [DBID]
AIDS-209853 [DBID]
  • Miscellaneous
    • Chemical Class:

      A phlorotannin isolated from a brown alga <ital>Ecklonia cava</ital> which exhibits antioxidant, hepatoprotective and anticoagulant activities. ChEBI CHEBI:65769

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.9±0.1 g/cm3
Boiling Point: 999.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 150.8±3.0 kJ/mol
Flash Point: 558.3±34.3 °C
Index of Refraction: 1.845
Molar Refractivity: 178.6±0.3 cm3
#H bond acceptors: 18
#H bond donors: 11
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 4
ACD/LogP: 5.87
ACD/LogD (pH 5.5): 4.55
ACD/BCF (pH 5.5): 1687.83
ACD/KOC (pH 5.5): 7087.96
ACD/LogD (pH 7.4): 4.31
ACD/BCF (pH 7.4): 970.70
ACD/KOC (pH 7.4): 4076.43
Polar Surface Area: 287 Å2
Polarizability: 70.8±0.5 10-24cm3
Surface Tension: 118.1±3.0 dyne/cm
Molar Volume: 401.4±3.0 cm3

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