ChemSpider 2D Image | Tomatoside A | C51H86O24

Tomatoside A

  • Molecular FormulaC51H86O24
  • Average mass1083.214 Da
  • Monoisotopic mass1082.550903 Da
  • ChemSpider ID103883581
  • defined stereocentres - 32 of 32 defined stereocentres


More details:






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

(3β,5α,22R,25S)-26-(β-D-Glucopyranosyloxy)-22-hydroxyfurostan-3-yl β-D-glucopyranosyl-(1->2)-β-D-glucopyranosyl-(1->4)-β-D-galactopyranoside [ACD/IUPAC Name]
(3β,5α,22R,25S)-26-(β-D-Glucopyranosyloxy)-22-hydroxyfurostan-3-yl-β-D-glucopyranosyl-(1->2)-β-D-glucopyranosyl-(1->4)-β-D-galactopyranosid [German] [ACD/IUPAC Name]
75557-22-1 [RN]
Tomatoside A
β-D-Galactopyranoside, (3β,5α,22β,25S)-26-(β-D-glucopyranosyloxy)-22-hydroxyfurostan-3-yl O-β-D-glucopyranosyl-(1->2)-O-β-D-glucopyranosyl-(1->4)- [ACD/Index Name]
β-D-Glucopyranosyl-(1->2)-β-D-glucopyranosyl-(1->4)-β-D-galactopyranoside de (3β,5α,22R,25S)-26-(β-D-glucopyranosyloxy)-22-hydroxyfurostan-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: 1.640
Molar Refractivity: 257.9±0.4 cm3
#H bond acceptors: 24
#H bond donors: 15
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: -1.44
ACD/LogD (pH 5.5): -2.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.81
ACD/LogD (pH 7.4): -2.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.81
Polar Surface Area: 387 Å2
Polarizability: 102.2±0.5 10-24cm3
Surface Tension: 85.6±5.0 dyne/cm
Molar Volume: 715.5±5.0 cm3

Click to predict properties on the Chemicalize site






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