ChemSpider 2D Image | 1-O-[3-(Hexopyranuronosyloxy)-28-oxoolean-12-en-28-yl]hexopyranose | C42H65O14

1-O-[3-(Hexopyranuronosyloxy)-28-oxoolean-12-en-28-yl]hexopyranose

  • Molecular FormulaC42H65O14
  • Average mass793.958 Da
  • Monoisotopic mass793.437988 Da
  • ChemSpider ID24784883

  • Charge - Charge

More details:

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

1-O-[3-(Hexopyranuronosyloxy)-28-oxoolean-12-en-28-yl]hexopyranose [ACD/IUPAC Name]
1-O-[3-(Hexopyranuronosyloxy)-28-oxoolean-12-en-28-yl]hexopyranose [German] [ACD/IUPAC Name]
1-O-[3-(Hexopyranuronosyloxy)-28-oxooléan-12-én-28-yl]hexopyranose [French] [ACD/IUPAC Name]
Hexopyranose, 1-O-[3-(hexopyranuronosyloxy)-28-oxoolean-12-en-28-yl]-, ion(1-) [ACD/Index Name]
oleanolate 3-β-D-glucuronoside-28-glucoside

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

Density:
Boiling Point: 873.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 144.2±6.0 kJ/mol
Flash Point: 255.6±27.8 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 14
#H bond donors: 8
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 4
ACD/LogP: 6.37
ACD/LogD (pH 5.5): 2.37
ACD/BCF (pH 5.5): 7.79
ACD/KOC (pH 5.5): 23.96
ACD/LogD (pH 7.4): 1.47
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.05
Polar Surface Area: 236 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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