ChemSpider 2D Image | beta-D-GalNAc-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc(1->3)-beta-D-Gal-(1->4)-D-Glc | C34H58N2O25

β-D-GalNAc-(1->4)-[α-L-Fuc-(1->3)]-β-D-GlcNAc(1->3)-β-D-Gal-(1->4)-D-Glc

  • Molecular FormulaC34H58N2O25
  • Average mass894.823 Da
  • Monoisotopic mass894.332886 Da
  • ChemSpider ID30786378

  • defined stereocentres - 24 of 25 defined stereocentres

More details:

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

2-Acetamido-2-deoxy-β-D-galactopyranosyl-(1->4)-[6-deoxy-α-L-galactopyranosyl-(1->3)]-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->3)-β-D-galactopyranosyl-(1->4)-D-glucopyranose [ACD/IUPAC Name]
2-Acetamido-2-desoxy-β-D-galactopyranosyl-(1->4)-[6-desoxy-α-L-galactopyranosyl-(1->3)]-2-acetamido-2-desoxy-β-D-glucopyranosyl-(1->3)-β-D-galactopyranosyl-(1->;4)-D-glucopyranose [German] [ACD/IUPAC Name]
2-Acétamido-2-désoxy-β-D-galactopyranosyl-(1->4)-[6-désoxy-α-L-galactopyranosyl-(1->3)]-2-acétamido-2-désoxy-β-D-glucopyranosyl-(1->3)-β-D-galactopyranosyl-(1->;4)-D-glucopyranose [French] [ACD/IUPAC Name]
D-Glucopyranose, O-2-(acetylamino)-2-deoxy-β-D-galactopyranosyl-(1->4)-O-[6-deoxy-α-L-galactopyranosyl-(1->3)]-O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->3)-O-β-D-galactopyranosyl-( 1->4)- [ACD/Index Name]
β-D-GalNAc-(1->4)-[α-L-Fuc-(1->3)]-β-D-GlcNAc(1->;3)-β-D-Gal-(1->4)-D-Glc
lacdiNAc fucopentaose
LDNFP
missing
N-acetyl-β-D-galactosaminyl-(1->4)-[α-L-fucosyl-(1->;3)]-N-acetyl-β-D-glucosyl-(1->3)-β-D-galactosyl-(1->4)-D-glucopyranose
β-D-GalpNAc-(1->4)-[α-L-Fucp-(1->;3)]-β-D-GlcpNAc(1->3)-β-D-Galp-(1->4)-D-Glcp
  • Miscellaneous

    • Chemical Class:

      An amino pentasaccharide consisting of a di-<element>N</element>-acetylated lactosediamine to which is linked (1<arrow>right</arrow>3) an <stereo>alpha</stereo>-<stereo>L</stereo>-fucosyl residue and which is in turn linked (1<arrow>right</arrow>3) to the galectose residue of a second lactose moiety. Saccharide portion of the antigen lacdiNAc fucopentaose-BSA. ChEBI CHEBI:77878
      An amino pentasaccharide consisting of a di-N-acetylated lactosediamine to which is linked (1->3) an alpha-L-fucosyl residue and which is in turn linked (1->3) to the galectose residue of a second lac tose moiety. Saccharide portion of the antigen lacdiNAc fucopentaose-BSA. ChEBI CHEBI:77878
      An amino pentasaccharide consisting of a di-N-acetylated lactosediamine to which is linked (1right3) an alpha-L-fucosyl residue and ; which is in turn linked (1right3) to the galectose residue of a se cond lactose moiety. Saccharide portion of the antigen lacdiNAc fucopentaose-BSA. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:77878

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

Density: 1.7±0.1 g/cm3
Boiling Point: 1258.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 211.7±6.0 kJ/mol
Flash Point: 714.7±34.3 °C
Index of Refraction: 1.656
Molar Refractivity: 193.4±0.4 cm3
#H bond acceptors: 27
#H bond donors: 16
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: -1.83
ACD/LogD (pH 5.5): -3.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 424 Å2
Polarizability: 76.7±0.5 10-24cm3
Surface Tension: 103.9±5.0 dyne/cm
Molar Volume: 526.8±5.0 cm3

Click to predict properties on the Chemicalize site


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