ChemSpider 2D Image | GalNAcGlcNAcGA | C18H30N2O12

GalNAcGlcNAcGA

  • Molecular FormulaC18H30N2O12
  • Average mass466.437 Da
  • Monoisotopic mass466.179871 Da
  • ChemSpider ID24606162

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

2-Acétamido-4-O-(2-acétamido-2-désoxy-β-L-galactopyranosyl)-2-désoxy-β-L-glucopyranoside de 2-oxoéthyle [French] [ACD/IUPAC Name]
2-Désoxy-4-O-{2-désoxy-2-[(E)-(1-hydroxyéthylidène)amino]-β-L-galactopyranosyl}-2-[(E)-(1-hydroxyéthylidène)amino]-β-L-glucopyranoside de 2-oxoéthyle [French] [ACD/IUPAC Name]
2-Oxoethyl 2-acetamido-4-O-(2-acetamido-2-deoxy-β-L-galactopyranosyl)-2-deoxy-β-L-glucopyranoside [ACD/IUPAC Name]
2-Oxoethyl 2-deoxy-4-O-{2-deoxy-2-[(E)-(1-hydroxyethylidene)amino]-β-L-galactopyranosyl}-2-[(E)-(1-hydroxyethylidene)amino]-β-L-glucopyranoside [ACD/IUPAC Name]
2-Oxoethyl-2-acetamido-4-O-(2-acetamido-2-desoxy-β-L-galactopyranosyl)-2-desoxy-β-L-glucopyranosid [German] [ACD/IUPAC Name]
2-Oxoethyl-2-desoxy-4-O-{2-desoxy-2-[(E)-(1-hydroxyethyliden)amino]-β-L-galactopyranosyl}-2-[(E)-(1-hydroxyethyliden)amino]-β-L-glucopyranosid [German] [ACD/IUPAC Name]
GalNAcGlcNAcGA
β-L-Glucopyranoside, 2-oxoethyl 2-(acetylamino)-4-O-[2-(acetylamino)-2-deoxy-β-L-galactopyranosyl]-2-deoxy- [ACD/Index Name]
β-L-Glucopyranoside, 2-oxoethyl 2-deoxy-4-O-[2-deoxy-2-[[(1E)-1-hydroxyethylidene]amino]-β-L-galactopyranosyl]-2-[[(1E)-1-hydroxyethylidene]amino]- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 809.1±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.5 mmHg at 25°C
Enthalpy of Vaporization: 133.9±6.0 kJ/mol
Flash Point: 443.1±37.1 °C
Index of Refraction: 1.630
Molar Refractivity: 98.5±0.5 cm3
#H bond acceptors: 14
#H bond donors: 7
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: -0.08
ACD/LogD (pH 5.5): -0.97
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.96
ACD/LogD (pH 7.4): -0.96
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.08
Polar Surface Area: 220 Å2
Polarizability: 39.1±0.5 10-24cm3
Surface Tension: 64.9±7.0 dyne/cm
Molar Volume: 277.0±7.0 cm3

Click to predict properties on the Chemicalize site


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