ChemSpider 2D Image | 1-O-[(2beta,3beta,6beta)-2,3,6,23-Tetrahydroxy-28-oxoolean-12-en-28-yl]-alpha-L-arabinopyranose | C35H56O10

1-O-[(2β,3β,6β)-2,3,6,23-Tetrahydroxy-28-oxoolean-12-en-28-yl]-α-L-arabinopyranose

  • Molecular FormulaC35H56O10
  • Average mass636.813 Da
  • Monoisotopic mass636.387329 Da
  • ChemSpider ID10255872

  • defined stereocentres - 15 of 15 defined stereocentres

More details:

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

1-O-[(2β,3β,6β)-2,3,6,23-Tetrahydroxy-28-oxoolean-12-en-28-yl]-α-L-arabinopyranose [ACD/IUPAC Name]
1-O-[(2β,3β,6β)-2,3,6,23-Tetrahydroxy-28-oxoolean-12-en-28-yl]-α-L-arabinopyranose [German] [ACD/IUPAC Name]
1-O-[(2β,3β,6β)-2,3,6,23-Tétrahydroxy-28-oxooléan-12-én-28-yl]-α-L-arabinopyranose [French] [ACD/IUPAC Name]
67258-70-2 [RN]
α-L-Arabinopyranose, 1-O-[(2β,3β,6β)-2,3,6,23-tetrahydroxy-28-oxoolean-12-en-28-yl]- [ACD/Index Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL491706/
Madlongiside C

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

Density: 1.3±0.1 g/cm3
Boiling Point: 736.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.5 mmHg at 25°C
Enthalpy of Vaporization: 122.7±6.0 kJ/mol
Flash Point: 224.1±26.4 °C
Index of Refraction: 1.610
Molar Refractivity: 165.7±0.4 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 3
ACD/LogP: 4.06
ACD/LogD (pH 5.5): 3.80
ACD/BCF (pH 5.5): 455.33
ACD/KOC (pH 5.5): 2782.48
ACD/LogD (pH 7.4): 3.80
ACD/BCF (pH 7.4): 455.32
ACD/KOC (pH 7.4): 2782.45
Polar Surface Area: 177 Å2
Polarizability: 65.7±0.5 10-24cm3
Surface Tension: 65.8±5.0 dyne/cm
Molar Volume: 478.0±5.0 cm3

Click to predict properties on the Chemicalize site


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