ChemSpider 2D Image | 4-O-(4,6-Dideoxy-4-{[(1S,2S,3S,4R,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]amino}-alpha-D-glucopyranosyl)-beta-D-glucopyranose | C19H35NO13

4-O-(4,6-Dideoxy-4-{[(1S,2S,3S,4R,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]amino}-α-D-glucopyranosyl)-β-D-glucopyranose

  • Molecular FormulaC19H35NO13
  • Average mass485.480 Da
  • Monoisotopic mass485.211000 Da
  • ChemSpider ID25061215

  • defined stereocentres - 15 of 15 defined stereocentres

More details:

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

4-O-(4,6-Dideoxy-4-{[(1S,2S,3S,4R,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]amino}-α-D-glucopyranosyl)-β-D-glucopyranose [ACD/IUPAC Name]
4-O-(4,6-Didesoxy-4-{[(1S,2S,3S,4R,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]amino}-α-D-glucopyranosyl)-β-D-glucopyranose [German] [ACD/IUPAC Name]
4-O-(4,6-Didésoxy-4-{[(1S,2S,3S,4R,5R)-2,3,4-trihydroxy-5-(hydroxyméthyl)cyclohexyl]amino}-α-D-glucopyranosyl)-β-D-glucopyranose [French] [ACD/IUPAC Name]
β-D-Glucopyranose, 4-O-[4,6-dideoxy-4-[[(1S,2S,3S,4R,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]amino]-α-D-glucopyranosyl]- [ACD/Index Name]

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

Density: 1.7±0.0 g/cm3
Boiling Point: 775.6±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 128.7±0.0 kJ/mol
Flash Point: 422.9±0.0 °C
Index of Refraction: 1.657
Molar Refractivity: 107.8±0.0 cm3
#H bond acceptors: 14
#H bond donors: 11
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 242 Å2
Polarizability: 42.7±0.0 10-24cm3
Surface Tension: 102.1±0.0 dyne/cm
Molar Volume: 293.1±0.0 cm3

Click to predict properties on the Chemicalize site


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