ChemSpider 2D Image | 2-Acetamido-2-deoxy-3-O-hexopyranuronosyl-4-O-sulfonatohexopyranose | C14H21NO15S

2-Acetamido-2-deoxy-3-O-hexopyranuronosyl-4-O-sulfonatohexopyranose

  • Molecular FormulaC14H21NO15S
  • Average mass475.380 Da
  • Monoisotopic mass475.064301 Da
  • ChemSpider ID21428960

  • Charge - Charge

More details:

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

2-Acetamido-2-deoxy-3-O-hexopyranuronosyl-4-O-sulfonatohexopyranose [ACD/IUPAC Name]
2-Acetamido-2-desoxy-3-O-hexopyranuronosyl-4-O-sulfonatohexopyranose [German] [ACD/IUPAC Name]
2-Acétamido-2-désoxy-3-O-hexopyranuronosyl-4-O-sulfonatohexopyranose [French] [ACD/IUPAC Name]
6-{[3-Acetamido-2-hydroxy-6-(hydroxymethyl)-5-(sulfonatooxy)tetrahydro-2H-pyran-4-yl]oxy}-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylat
6-{[3-Acetamido-2-hydroxy-6-(hydroxymethyl)-5-(sulfonatooxy)tetrahydro-2H-pyran-4-yl]oxy}-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylate
6-{[3-Acétamido-2-hydroxy-6-(hydroxyméthyl)-5-(sulfonatooxy)tétrahydro-2H-pyran-4-yl]oxy}-3,4,5-trihydroxytétrahydro-2H-pyran-2-carboxylate
6-{[3-Acetamido-2-hydroxy-6-(hydroxymethyl)-5-(sulfonatooxy)tetrahydro-2H-pyran-4-yl]oxy}-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylate (non-preferred name)
Hexopyranose, 2-(acetylamino)-2-deoxy-3-O-hexopyranuronosyl-, 4-(hydrogen sulfate), ion(2-) [ACD/Index Name]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 16
#H bond donors: 8
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: -4.47
ACD/LogD (pH 5.5): -9.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -9.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 273 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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