ChemSpider 2D Image | Tigogenin pentasaccharide | C55H90O26

Tigogenin pentasaccharide

  • Molecular FormulaC55H90O26
  • Average mass1167.287 Da
  • Monoisotopic mass1166.572021 Da
  • ChemSpider ID10250654

  • defined stereocentres - 35 of 35 defined stereocentres

More details:

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

(3β,5α,25R)-Spirostan-3-yl β-D-xylopyranosyl-(1->3)-[β-D-xylopyranosyl-(1->3)-β-D-glucopyranosyl-(1->2)]-β-D-glucopyranosyl-(1->4)-β-D-galactopyranoside [ACD/IUPAC Name]
(3β,5α,25R)-Spirostan-3-yl-β-D-xylopyranosyl-(1->3)-[β-D-xylopyranosyl-(1->3)-β-D-glucopyranosyl-(1->2)]-β-D-glucopyranosyl-(1->4)-β-D-galactopyranosid [German] [ACD/IUPAC Name]
Tigogenin pentasaccharide
β-D-Galactopyranoside, (3β,5α,25R)-spirostan-3-yl O-β-D-xylopyranosyl-(1->;3)-O-[O-β-D-xylopyranosyl-(1->3)-β-D-glucopyranosyl-(1->2)]-O-β-D-glucopyranosyl-(1->4)- [ACD/Index Name]
β-D-Xylopyranosyl-(1->3)-[β-D-xylopyranosyl-(1->3)-β-D-glucopyranosyl-(1->2)]-β-D-glucopyranosyl-(1->4)-β-D-galactopyranoside de (3β,5α,25R)-spirostan-3-yle [French] [ACD/IUPAC Name]
tigogenin 3-O-β-D-xyloyranosyl-(1->3)-β-D-glucopyranosyl-(1->2)-[β-D-xyloyranosyl-(1->3)]-β-D-glucopyranosyl-(1->4)-β-D-galactopyranoside

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: 1.642
Molar Refractivity: 276.0±0.4 cm3
#H bond acceptors: 26
#H bond donors: 14
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: 4.66
ACD/LogD (pH 5.5): 2.87
ACD/BCF (pH 5.5): 89.16
ACD/KOC (pH 5.5): 865.49
ACD/LogD (pH 7.4): 2.87
ACD/BCF (pH 7.4): 89.16
ACD/KOC (pH 7.4): 865.49
Polar Surface Area: 394 Å2
Polarizability: 109.4±0.5 10-24cm3
Surface Tension: 84.5±5.0 dyne/cm
Molar Volume: 763.7±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement