ChemSpider 2D Image | Arjunglucoside II | C36H58O10

Arjunglucoside II

  • Molecular FormulaC36H58O10
  • Average mass650.840 Da
  • Monoisotopic mass650.403015 Da
  • ChemSpider ID30785556

  • defined stereocentres - 15 of 15 defined stereocentres

More details:

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

1-O-[(2α,3β)-2,3,23-Trihydroxy-28-oxoolean-12-en-28-yl]-β-D-glucopyranose [German] [ACD/IUPAC Name]
1-O-[(2α,3β)-2,3,23-Trihydroxy-28-oxoolean-12-en-28-yl]-β-D-glucopyranose [ACD/IUPAC Name]
1-O-[(2α,3β)-2,3,23-Trihydroxy-28-oxooléan-12-én-28-yl]-β-D-glucopyranose [French] [ACD/IUPAC Name]
2α,3β,23-trihydroxyolean-12-en-28-oic acid 28-O-β-D-glucopynoside
62369-72-6 [RN]
Arjunglucoside II
β-D-Glucopyranose, 1-O-[(2α,3β)-2,3,23-trihydroxy-28-oxoolean-12-en-28-yl]- [ACD/Index Name]
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10R,11R,12aR,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
1-O-[2α,3β,23-trihydroxy-28-oxoolean-12-en-28-yl]-β-D-glucopyranose
arjunolic acid-28-O-glucoside
  • Miscellaneous

    • Chemical Class:

      A triterpenoid saponin that is the carboxylic ester obtained by the formal condensation of the carboxy group of arjunolic acid with <stereo>beta</stereo>-<stereo>D</stereo>-glucopyranose. It has bee n isolated from <ital>Juglans sinensis</ital>. ChEBI CHEBI:67948
      A triterpenoid saponin that is the carboxylic ester obtained by the formal condensation of the carboxy group of arjunolic acid with beta-D-glucopyranose. It has bee; n isolated from Juglans sinensis . ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:67948
      A triterpenoid saponin that is the carboxylic ester obtained by the formal condensation of the carboxy group of arjunolic acid with beta-D-glucopyranose. It has been isolated from Juglans sinensis. ChEBI CHEBI:67948

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

Density: 1.3±0.1 g/cm3
Boiling Point: 744.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.6 mmHg at 25°C
Enthalpy of Vaporization: 123.9±6.0 kJ/mol
Flash Point: 224.7±26.4 °C
Index of Refraction: 1.606
Molar Refractivity: 170.3±0.4 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 4
ACD/LogP: 5.50
ACD/LogD (pH 5.5): 4.79
ACD/BCF (pH 5.5): 2556.92
ACD/KOC (pH 5.5): 9568.39
ACD/LogD (pH 7.4): 4.79
ACD/BCF (pH 7.4): 2556.88
ACD/KOC (pH 7.4): 9568.27
Polar Surface Area: 177 Å2
Polarizability: 67.5±0.5 10-24cm3
Surface Tension: 64.8±5.0 dyne/cm
Molar Volume: 494.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement