ChemSpider 2D Image | (3beta,5beta,25S)-Spirostan-3-yl beta-D-galactopyranoside | C33H54O8

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

  • Molecular FormulaC33H54O8
  • Average mass578.777 Da
  • Monoisotopic mass578.381897 Da
  • ChemSpider ID57620926
  • defined stereocentres - 16 of 17 defined stereocentres


More details:






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

(3β,5β,25S)-Spirostan-3-yl β-D-galactopyranoside [ACD/IUPAC Name]
(3β,5β,25S)-Spirostan-3-yl-β-D-galactopyranosid [German] [ACD/IUPAC Name]
β-D-Galactopyranoside de (3β,5β,25S)-spirostan-3-yle [French] [ACD/IUPAC Name]
β-D-Galactopyranoside, (3β,5β,25S)-spirostan-3-yl [ACD/Index Name]
?-?D-?Galactopyranoside, (3?,?5?,?25S)?-?spirostan-?3-?yl
68422-00-4 [RN]
Timosaponin A1

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

Density: 1.3±0.1 g/cm3
Boiling Point: 695.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.0 mmHg at 25°C
Enthalpy of Vaporization: 116.5±6.0 kJ/mol
Flash Point: 374.4±31.5 °C
Index of Refraction: 1.583
Molar Refractivity: 153.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 4.24
ACD/LogD (pH 5.5): 3.94
ACD/BCF (pH 5.5): 585.40
ACD/KOC (pH 5.5): 3330.77
ACD/LogD (pH 7.4): 3.94
ACD/BCF (pH 7.4): 585.40
ACD/KOC (pH 7.4): 3330.74
Polar Surface Area: 118 Å2
Polarizability: 60.8±0.5 10-24cm3
Surface Tension: 56.1±5.0 dyne/cm
Molar Volume: 458.7±5.0 cm3

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