ChemSpider 2D Image | Uliginosin A | C28H36O8

Uliginosin A

  • Molecular FormulaC28H36O8
  • Average mass500.581 Da
  • Monoisotopic mass500.241028 Da
  • ChemSpider ID16736080

More details:

Featured data source
Natural Product Updates

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

19809-78-0 [RN]
2,5-Cyclohexadien-1-one, 3,5-dihydroxy-4,4-dimethyl-2-(2-methyl-1-oxopropyl)-6-[[2,4,6-trihydroxy-3-(3-methyl-2-buten-1-yl)-5-(2-methyl-1-oxopropyl)phenyl]methyl]- [ACD/Index Name]
3,5-Dihydroxy-2-isobutyryl-4,4-dimethyl-6-[2,4,6-trihydroxy-3-isobutyryl-5-(3-methyl-2-buten-1-yl)benzyl]-2,5-cyclohexadien-1-on [German] [ACD/IUPAC Name]
3,5-Dihydroxy-2-isobutyryl-4,4-dimethyl-6-[2,4,6-trihydroxy-3-isobutyryl-5-(3-methyl-2-buten-1-yl)benzyl]-2,5-cyclohexadien-1-one [ACD/IUPAC Name]
3,5-Dihydroxy-2-isobutyryl-4,4-diméthyl-6-[2,4,6-trihydroxy-3-isobutyryl-5-(3-méthyl-2-butén-1-yl)benzyl]-2,5-cyclohexadién-1-one [French] [ACD/IUPAC Name]
3'-[(2,4-Dihydroxy-5-isobutyryl-3,3-dimethyl-6-oxo-1,4-cyclohexadien-1-yl)methyl]-2',4',6'-trihydroxy-2-methyl-5'-(3-methyl-2-butenyl)propiophenone
Uliginosin A

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

WPY2P733PC [DBID]
UNII:WPY2P733PC [DBID]
UNII-WPY2P733PC [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 720.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 110.4±3.0 kJ/mol
Flash Point: 403.2±29.4 °C
Index of Refraction: 1.605
Molar Refractivity: 135.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 6.94
ACD/LogD (pH 5.5): 4.03
ACD/BCF (pH 5.5): 324.52
ACD/KOC (pH 5.5): 918.36
ACD/LogD (pH 7.4): 1.95
ACD/BCF (pH 7.4): 2.76
ACD/KOC (pH 7.4): 7.80
Polar Surface Area: 152 Å2
Polarizability: 53.7±0.5 10-24cm3
Surface Tension: 57.9±3.0 dyne/cm
Molar Volume: 392.8±3.0 cm3

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