ChemSpider 2D Image | Heloside B | C33H56O10

Heloside B

  • Molecular FormulaC33H56O10
  • Average mass612.792 Da
  • Monoisotopic mass612.387329 Da
  • ChemSpider ID35518325

  • defined stereocentres - 17 of 17 defined stereocentres

More details:

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

(3β,11α,16β,22R,25R)-11,16,22,26-Tetrahydroxycholest-5-en-3-yl β-D-glucopyranoside [ACD/IUPAC Name]
(3β,11α,16β,22R,25R)-11,16,22,26-Tetrahydroxycholest-5-en-3-yl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
Heloside B
β-D-Glucopyranoside de (3β,11α,16β,22R,25R)-11,16,22,26-tétrahydroxycholest-5-én-3-yle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, (3β,11α,16β,22R,25R)-11,16,22,26-tetrahydroxycholest-5-en-3-yl [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 809.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.5 mmHg at 25°C
Enthalpy of Vaporization: 134.0±6.0 kJ/mol
Flash Point: 443.3±34.3 °C
Index of Refraction: 1.601
Molar Refractivity: 159.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 8
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: -0.17
ACD/LogD (pH 5.5): 0.43
ACD/BCF (pH 5.5): 1.25
ACD/KOC (pH 5.5): 40.95
ACD/LogD (pH 7.4): 0.43
ACD/BCF (pH 7.4): 1.25
ACD/KOC (pH 7.4): 40.95
Polar Surface Area: 180 Å2
Polarizability: 63.3±0.5 10-24cm3
Surface Tension: 65.5±5.0 dyne/cm
Molar Volume: 466.6±5.0 cm3

Click to predict properties on the Chemicalize site


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