ChemSpider 2D Image | 5-Acetamido-3,5-dideoxy-6-(1,2,3-trihydroxypropyl)hex-2-ulopyranonosyl-(2->3)hexopyranosyl-(1->3)-[6-deoxyhexopyranosyl-(1->4)]-2-acetamido-2-deoxyhexose | C31H52N2O23

5-Acetamido-3,5-dideoxy-6-(1,2,3-trihydroxypropyl)hex-2-ulopyranonosyl-(2->3)hexopyranosyl-(1->3)-[6-deoxyhexopyranosyl-(1->4)]-2-acetamido-2-deoxyhexose

  • Molecular FormulaC31H52N2O23
  • Average mass820.744 Da
  • Monoisotopic mass820.296082 Da
  • ChemSpider ID2595979

More details:

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

5-Acetamido-3,5-dideoxy-6-(1,2,3-trihydroxypropyl)hex-2-ulopyranonosyl-(2->3)hexopyranosyl-(1->3)-[6-deoxyhexopyranosyl-(1->4)]-2-acetamido-2-deoxyhexose [ACD/IUPAC Name]
5-Acetamido-3,5-didesoxy-6-(1,2,3-trihydroxypropyl)hex-2-ulopyranonosyl-(2->3)hexopyranosyl-(1->3)-[6-desoxyhexopyranosyl-(1->4)]-2-acetamido-2-desoxyhexose [German] [ACD/IUPAC Name]
5-Acétamido-3,5-didésoxy-6-(1,2,3-trihydroxypropyl)hex-2-ulopyranonosyl-(2->3)hexopyranosyl-(1->3)-[6-désoxyhexopyranosyl-(1->4)]-2-acétamido-2-désoxyhexose [French] [ACD/IUPAC Name]
Hexose, O-5-(acetylamino)-3,5-dideoxy-2-nonulopyranonosyl-(2->3)-O-hexopyranosyl-(1->3)-O-[6-deoxyhexopyranosyl-(1->4)]-2-(acetylamino)-2-deoxy- [ACD/Index Name]
3′-Sialyl-Lewis-a tetrasaccharide
3'-SLea
92448-22-1 [RN]

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

S2279_SIGMA [DBID]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 1285.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 217.0±6.0 kJ/mol
Flash Point: 731.4±34.3 °C
Index of Refraction: 1.641
Molar Refractivity: 177.5±0.4 cm3
#H bond acceptors: 25
#H bond donors: 15
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 3
ACD/LogP: -1.17
ACD/LogD (pH 5.5): -6.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 411 Å2
Polarizability: 70.3±0.5 10-24cm3
Surface Tension: 102.4±5.0 dyne/cm
Molar Volume: 492.0±5.0 cm3

Click to predict properties on the Chemicalize site


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