ChemSpider 2D Image | (25RS)-Schidigera saponin F1 | C44H72O18

(25RS)-Schidigera saponin F1

  • Molecular FormulaC44H72O18
  • Average mass889.032 Da
  • Monoisotopic mass888.471863 Da
  • ChemSpider ID8994805

  • defined stereocentres - 26 of 27 defined stereocentres

More details:

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

(25RS)-Schidigera saponin F1
(2β,3β,5β)-2-Hydroxyspirostan-3-yl β-D-glucopyranosyl-(1->2)-[β-D-xylopyranosyl-(1->3)]-β-D-galactopyranoside [ACD/IUPAC Name]
(2β,3β,5β)-2-Hydroxyspirostan-3-yl-β-D-glucopyranosyl-(1->2)-[β-D-xylopyranosyl-(1->3)]-β-D-galactopyranosid [German] [ACD/IUPAC Name]
266998-42-9 [RN]
β-D-Galactopyranoside, (2β,3β,5β)-2-hydroxyspirostan-3-yl O-β-D-glucopyranosyl-(1->2)-O-[β-D-xylopyranosyl-(1->3)]- [ACD/Index Name]
β-D-Glucopyranosyl-(1->2)-[β-D-xylopyranosyl-(1->3)]-β-D-galactopyranoside de (2β,3β,5β)-2-hydroxyspirostan-3-yle [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.627
Molar Refractivity: 216.2±0.4 cm3
#H bond acceptors: 18
#H bond donors: 10
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 2.77
ACD/LogD (pH 5.5): 1.80
ACD/BCF (pH 5.5): 13.75
ACD/KOC (pH 5.5): 227.03
ACD/LogD (pH 7.4): 1.80
ACD/BCF (pH 7.4): 13.75
ACD/KOC (pH 7.4): 227.03
Polar Surface Area: 276 Å2
Polarizability: 85.7±0.5 10-24cm3
Surface Tension: 76.1±5.0 dyne/cm
Molar Volume: 609.6±5.0 cm3

Click to predict properties on the Chemicalize site


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