ChemSpider 2D Image | (3beta,5alpha,25S)-Spirosolan-3-yl beta-D-galactopyranoside | C33H55NO7

(3β,5α,25S)-Spirosolan-3-yl β-D-galactopyranoside

  • Molecular FormulaC33H55NO7
  • Average mass577.792 Da
  • Monoisotopic mass577.397827 Da
  • ChemSpider ID58837333
  • defined stereocentres - 17 of 17 defined stereocentres


More details:






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

(3β,5α,25S)-Spirosolan-3-yl β-D-galactopyranoside [ACD/IUPAC Name]
(3β,5α,25S)-Spirosolan-3-yl-β-D-galactopyranosid [German] [ACD/IUPAC Name]
β-D-Galactopyranoside de (3β,5α,25S)-spirosolan-3-yle [French] [ACD/IUPAC Name]
β-D-Galactopyranoside, (3β,5α,25S)-spirosolan-3-yl [ACD/Index Name]
tomatidine galactoside

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

Density: 1.3±0.1 g/cm3
Boiling Point: 704.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.1 mmHg at 25°C
Enthalpy of Vaporization: 117.9±6.0 kJ/mol
Flash Point: 380.1±32.9 °C
Index of Refraction: 1.590
Molar Refractivity: 155.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: 4.18
ACD/LogD (pH 5.5): 0.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.80
ACD/LogD (pH 7.4): 2.45
ACD/BCF (pH 7.4): 20.28
ACD/KOC (pH 7.4): 124.40
Polar Surface Area: 121 Å2
Polarizability: 61.6±0.5 10-24cm3
Surface Tension: 56.8±5.0 dyne/cm
Molar Volume: 460.2±5.0 cm3

Click to predict properties on the Chemicalize site






Advertisement