ChemSpider 2D Image | 5-Aminopentyl 6-deoxy-alpha-L-mannopyranosyl-(1->4)-[beta-D-glucopyranosyl-(1->3)]-2-acetamido-2-deoxy-beta-D-galactopyranoside | C25H46N2O15

5-Aminopentyl 6-deoxy-α-L-mannopyranosyl-(1->4)-[β-D-glucopyranosyl-(1->3)]-2-acetamido-2-deoxy-β-D-galactopyranoside

  • Molecular FormulaC25H46N2O15
  • Average mass614.637 Da
  • Monoisotopic mass614.289795 Da
  • ChemSpider ID76963235

  • defined stereocentres - 15 of 15 defined stereocentres

More details:

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

5-Aminopentyl 6-deoxy-α-L-mannopyranosyl-(1->4)-[β-D-glucopyranosyl-(1->3)]-2-acetamido-2-deoxy-β-D-galactopyranoside [ACD/IUPAC Name]
5-Aminopentyl-6-desoxy-α-L-mannopyranosyl-(1->4)-[β-D-glucopyranosyl-(1->3)]-2-acetamido-2-desoxy-β-D-galactopyranosid [German] [ACD/IUPAC Name]
6-Désoxy-α-L-mannopyranosyl-(1->4)-[β-D-glucopyranosyl-(1->3)]-2-acétamido-2-désoxy-β-D-galactopyranoside de 5-aminopentyle [French] [ACD/IUPAC Name]
β-D-Galactopyranoside, 5-aminopentyl O-6-deoxy-α-L-mannopyranosyl-(1->4)-O-[β-D-glucopyranosyl-(1->3)]-2-(acetylamino)-2-deoxy- [ACD/Index Name]
5-aminopentyl α-L-rhamnosyl-(1->4)-[β-D-glucosyl-(1->3)]-N-acetyl-β-D-galactosaminide
5-aminopentyl β-D-glucosyl-(1->3)-[α-L-rhamnosyl-(1->4)]-N-acetyl-β-D-galactosaminide
Glcbeta1-3(Rhaalpha1-4)GalNAcO[CH2]5NH2
missing
Rhaalpha1-4(Glcbeta1-3)GalNAcO[CH2]5NH2
α-L-Rha-(1->4)-[β-D-Glc-(1->3)]-β-D-GalNAcO[CH2]5NH2
More...
  • Miscellaneous

    • Chemical Class:

      A branched trisaccharide derivative consisting of a disaccharide unit of beta-D-glucose and N-acetyl-beta-D-galac; tosamine residues linked (1right3), to the N-acetylgalactosamine residue of which is also linked (1right4) an alpha-L; -rhamnosyl residue, the whole linked glycosidically to a 5-aminopentyl group. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:140512
      A branched trisaccharide derivative consisting of a disaccharide unit of beta-D-glucose and N-acetyl-beta-D-galactosamine residues linked (1->3), to the N-acetylgalactosamine residue of which is also linked (1->4) an alpha-L-rhamnosyl residue, the whole linked glycosidically to a 5-aminopentyl group. ChEBI CHEBI:140512

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

Density: 1.5±0.1 g/cm3
Boiling Point: 899.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 148.5±6.0 kJ/mol
Flash Point: 497.9±34.3 °C
Index of Refraction: 1.601
Molar Refractivity: 141.5±0.4 cm3
#H bond acceptors: 17
#H bond donors: 11
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: -2.77
ACD/LogD (pH 5.5): -6.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.00
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 272 Å2
Polarizability: 56.1±0.5 10-24cm3
Surface Tension: 79.6±5.0 dyne/cm
Molar Volume: 413.1±5.0 cm3

Click to predict properties on the Chemicalize site


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