ChemSpider 2D Image | LNF III | C32H55NO25

LNF III

  • Molecular FormulaC32H55NO25
  • Average mass853.771 Da
  • Monoisotopic mass853.306335 Da
  • ChemSpider ID26332206

  • defined stereocentres - 24 of 25 defined stereocentres

More details:

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

6-Deoxy-α-L-galactopyranosyl-(1->3)-[β-D-galactopyranosyl-(1->4)]-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->3)-β-D-galactopyranosyl-(1->4)-D-glucopyranose [ACD/IUPAC Name]
6-Desoxy-α-L-galactopyranosyl-(1->3)-[β-D-galactopyranosyl-(1->4)]-2-acetamido-2-desoxy-β-D-glucopyranosyl-(1->3)-β-D-galactopyranosyl-(1->4)-D-glucopyranose [German] [ACD/IUPAC Name]
6-Désoxy-α-L-galactopyranosyl-(1->3)-[β-D-galactopyranosyl-(1->4)]-2-acétamido-2-désoxy-β-D-glucopyranosyl-(1->3)-β-D-galactopyranosyl-(1->4)-D-glucopyranose [French] [ACD/IUPAC Name]
D-Glucopyranose, O-6-deoxy-α-L-galactopyranosyl-(1->3)-O-[β-D-galactopyranosyl-(1->4)]-O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->3)-O-β-D-galactopyranosyl-(1->4)- [ACD/Index Name]
III3Fuc-nLcOse4
Lacto-N-fucopentaose III
LNF III
LNFP III
α-L-Fucp-(1->3)-[β-D-Galp-(1->4)]-β-D-GlcpNAc-(1->4)-β-D-Galp-(1->3)-D-Glcp
(Gal)2 (Glc)1 (GlcNAc)1 (LFuc)1
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

24717-73-5; 25541-09-7 [DBID]
  • Miscellaneous

    • Chemical Class:

      A branched amino pentasaccharide comprising one fucose, two galactose, one glucosamine and one glucose unit (at the reducing end), linked as shown. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:61352, CHEBI:61352
      A branched amino pentasaccharide consisting of D-glucose at the reducing end having an alpha-L-fucosyl-(1->3)-[beta-D-galactosyl-(1->4)]-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl moiety at tached at the 4-position. ChEBI CHEBI:61352

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

Density: 1.8±0.1 g/cm3
Boiling Point: 1191.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 199.2±6.0 kJ/mol
Flash Point: 674.1±34.3 °C
Index of Refraction: 1.668
Molar Refractivity: 181.9±0.4 cm3
#H bond acceptors: 26
#H bond donors: 16
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: -3.39
ACD/LogD (pH 5.5): -4.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 416 Å2
Polarizability: 72.1±0.5 10-24cm3
Surface Tension: 111.4±5.0 dyne/cm
Molar Volume: 488.0±5.0 cm3

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