ChemSpider 2D Image | alpha-D-GalpNAc-(1->3)-[alpha-L-Fucp-(1->2)]-beta-D-Galp-(1->4)-beta-D-GlcpNAc | C28H48N2O20

α-D-GalpNAc-(1->3)-[α-L-Fucp-(1->2)]-β-D-Galp-(1->4)-β-D-GlcpNAc

  • Molecular FormulaC28H48N2O20
  • Average mass732.682 Da
  • Monoisotopic mass732.280029 Da
  • ChemSpider ID26332731

  • defined stereocentres - 20 of 20 defined stereocentres

More details:

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

2-Acetamido-2-deoxy-α-D-galactopyranosyl-(1->3)-[6-deoxy-α-L-galactopyranosyl-(1->2)]-β-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranose [ACD/IUPAC Name]
2-Acetamido-2-desoxy-α-D-galactopyranosyl-(1->3)-[6-desoxy-α-L-galactopyranosyl-(1->2)]-β-D-galactopyranosyl-(1->4)-2-acetamido-2-desoxy-β-D-glucopyranose [German] [ACD/IUPAC Name]
2-Acétamido-2-désoxy-α-D-galactopyranosyl-(1->3)-[6-désoxy-α-L-galactopyranosyl-(1->2)]-β-D-galactopyranosyl-(1->4)-2-acétamido-2-désoxy-β-D-glucopyranose [French] [ACD/IUPAC Name]
α-D-GalpNAc-(1->3)-[α-L-Fucp-(1->;2)]-β-D-Galp-(1->4)-β-D-GlcpNAc
β-D-Glucopyranose, O-2-(acetylamino)-2-deoxy-α-D-galactopyranosyl-(1->3)-O-[6-deoxy-α-L-galactopyranosyl-(1->;2)]-O-β-D-galactopyranosyl-(1->4)-2-(acetylamino)-2-deoxy- [ACD/Index Name]
2-acetamido-2-deoxy-α-D-galactopyranosyl-(1->3)-[α-L-fucopyranosyl-(1->;2)]-β-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranose
A type 2
blood group A antigen type 2
blood group A type 2 tetrasaccharide
GalNAca1-3(Fuca1-2)Galb1-4GlcNAcb
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  • Miscellaneous

    • Chemical Class:

      A branched amino tetrasaccharide comprising <element>N</element>-acetyl-<stereo>beta</stereo>-<stereo>D</stereo>-glucosamine at the reducing end with a <element>N</element>-acetyl-<stereo>alpha</stere o>-<stereo>D</stereo>-galactosaminyl-(1<arrow>right</arrow>3)-[<stereo>alpha</stereo>-<stereo>L</stereo>-fucosyl-(1<arrow>right</arrow>2)]-<stereo>beta</stereo>-<stereo>D</stereo>-galactosyl moiety at tached at the 4-position. ChEBI CHEBI:62486
      A branched amino tetrasaccharide comprising N-acetyl-beta-D-glucosamine at the reducing end with a N-acetyl-alpha-D-galactosaminyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl moiety attached at the 4-position. ChEBI CHEBI:62486
      A branched amino tetrasaccharide comprising N-acetyl-beta-D-glucosamine at the reducing end with a N-acetyl-alpha-D-galactosaminyl-(1right3)-[alpha-L-fucosyl-(1right2)]-beta-D-galactosyl moiety at; ta ched at the 4-position. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:62486

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

Density: 1.7±0.1 g/cm3
Boiling Point: 1150.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 191.8±6.0 kJ/mol
Flash Point: 649.7±34.3 °C
Index of Refraction: 1.640
Molar Refractivity: 159.7±0.4 cm3
#H bond acceptors: 22
#H bond donors: 13
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: -1.30
ACD/LogD (pH 5.5): -2.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.06
ACD/LogD (pH 7.4): -2.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.06
Polar Surface Area: 345 Å2
Polarizability: 63.3±0.5 10-24cm3
Surface Tension: 96.3±5.0 dyne/cm
Molar Volume: 443.5±5.0 cm3

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