ChemSpider 2D Image | (3R,4R,5R)-3-Hydroxy-5-(hydroxymethyl)-4-piperidinyl beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranoside | C24H43NO18

(3R,4R,5R)-3-Hydroxy-5-(hydroxymethyl)-4-piperidinyl β-D-glucopyranosyl-(1->4)-β-D-glucopyranosyl-(1->4)-β-D-glucopyranoside

  • Molecular FormulaC24H43NO18
  • Average mass633.594 Da
  • Monoisotopic mass633.247986 Da
  • ChemSpider ID10140630

  • defined stereocentres - 18 of 18 defined stereocentres

More details:

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

(3R,4R,5R)-3-Hydroxy-5-(hydroxymethyl)-4-piperidinyl β-D-glucopyranosyl-(1->4)-β-D-glucopyranosyl-(1->4)-β-D-glucopyranoside [ACD/IUPAC Name]
(3R,4R,5R)-3-Hydroxy-5-(hydroxymethyl)-4-piperidinyl-β-D-glucopyranosyl-(1->4)-β-D-glucopyranosyl-(1->4)-β-D-glucopyranosid [German] [ACD/IUPAC Name]
(3r,4r,5r)-3-Hydroxy-5-(Hydroxymethyl)piperidin-4-Yl β-D-Glucopyranosyl-(1->4)-β-D-Glucopyranosyl-(1->4)-β-D-Glucopyranoside
β-D-Glucopyranoside, (3R,4R,5R)-3-hydroxy-5-(hydroxymethyl)-4-piperidinyl O-β-D-glucopyranosyl-(1->4)-O-β-D-glucopyranosyl-(1->4)- [ACD/Index Name]
β-D-Glucopyranosyl-(1->4)-β-D-glucopyranosyl-(1->4)-β-D-glucopyranoside de (3R,4R,5R)-3-hydroxy-5-(hydroxyméthyl)-4-pipéridinyle [French] [ACD/IUPAC Name]
G3I

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

Density: 1.7±0.1 g/cm3
Boiling Point: 983.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 162.5±6.0 kJ/mol
Flash Point: 548.6±34.3 °C
Index of Refraction: 1.666
Molar Refractivity: 137.1±0.4 cm3
#H bond acceptors: 19
#H bond donors: 13
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: -6.41
ACD/LogD (pH 5.5): -8.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 310 Å2
Polarizability: 54.4±0.5 10-24cm3
Surface Tension: 109.0±5.0 dyne/cm
Molar Volume: 368.7±5.0 cm3

Click to predict properties on the Chemicalize site


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