ChemSpider 2D Image | alpha-D-Mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyra
nosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose | C58H98N2O46

α-D-Mannopyranosyl-(1->2)-α-D-mannopyranosyl-(1->2)-α-D-mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->6)]-α-D-mannopyranosyl-(1->6)]-β-D-mannopyra nosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose

  • Molecular FormulaC58H98N2O46
  • Average mass1559.385 Da
  • Monoisotopic mass1558.539063 Da
  • ChemSpider ID34448561
  • defined stereocentres - 44 of 45 defined stereocentres


More details:






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

D-Glucopyranose, O-α-D-mannopyranosyl-(1->2)-O-α-D-mannopyranosyl-(1->2)-O-α-D-mannopyranosyl-(1->3)-O-[O-α-D-mannopyranosyl-(1->3)-O-[α-D-mannopyranosyl-(1->6)]-α-D-mannopyran osyl-(1->6)]-O-β-D-mannopyranosyl-(1->4)-O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->4)-2-(acetylamino)-2-deoxy- [ACD/Index Name]
α-D-Mannopyranosyl-(1->2)-α-D-mannopyranosyl-(1->2)-α-D-mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->6)]-α-D-mannopyranosyl-(1->6)]-β-D-mannopyra nosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose [ACD/IUPAC Name]
α-D-Mannopyranosyl-(1->2)-α-D-mannopyranosyl-(1->2)-α-D-mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->6)]-α-D-mannopyranosyl-(1->6)]-β-D-mannopyra nosyl-(1->4)-2-acetamido-2-desoxy-β-D-glucopyranosyl-(1->4)-2-acetamido-2-desoxy-D-glucopyranose [German] [ACD/IUPAC Name]
α-D-Mannopyranosyl-(1->2)-α-D-mannopyranosyl-(1->2)-α-D-mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->6)]-α-D-mannopyranosyl-(1->6)]-β-D-mannopyra nosyl-(1->4)-2-acétamido-2-désoxy-β-D-glucopyranosyl-(1->4)-2-acétamido-2-désoxy-D-glucopyranose [French] [ACD/IUPAC Name]
(GlcNAc)2 (Man)7
Man7GlcNAc2
missing
nosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose
WURCS=2.0/4,9,8/[a2122h-1x1-52*NCC/3=O][a2122h-1b1-52*NCC/3=O][a1122h-1b1-5][a1122h-1a1-5]/1-2-3-4-4-4-4-4-4/a4-b1b4-c1c3-d1c6-g1d2-e1e2-f1g3-h1_g6-i1
α-D-Man-(1->2)-α-D-Man-(1->2)-α-D-Man-(1->3)-[α-D-Man-(1->3)-[α-D-Man-(1->6)]-α-D-Man-(1->6)]-β-D-Man-(1->4)-β-D-GlcNAc-(1->4)-D-GlcNAc
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  • Miscellaneous
    • Chemical Class:

      An amino nonasaccharide that is the linear hexasaccharide <stereo>alpha</stereo>-<stereo>D</stereo>-Man-(1<arrow>right</arrow>2)-<stereo>alpha</stereo>-<stereo>D</stereo>-Man-(1<arrow>right</arrow>2)- <stereo>alpha</stereo>-<stereo>D</stereo>-Man-(1<arrow>right</arrow>3)-<stereo>beta</stereo>-<stereo>D</stereo>-Man-(1<arrow>right</arrow>4)-<stereo>beta</stereo>-<stereo>D</stereo>-GlcNAc-(1<arrow>ri ght</arrow>4)-<stereo>D</stereo>-GlcNAc in which the mannosyl residue nearest the reducing end has the branched trisaccharide <stereo>alpha</stereo>-<stereo>D</stereo>-Man-(1<arrow>right</arrow>3)-[<s tereo>alpha</stereo>-<stereo>D</stereo>-Man-(1<arrow>right</arrow>6)]-<stereo>alpha</stereo>-<stereo>D</stereo>-Man attached at position 6. ChEBI CHEBI:82646
      An amino nonasaccharide that is the linear hexasaccharide alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc in which the mannosyl residue nearest the reducing end has the branched trisaccharide alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-alpha-D-Man attached at position 6. ChEBI CHEBI:82646
      An amino nonasaccharide that is the linear hexasaccharide alpha-D-Man-(1right2)-alpha-D-Man-(1right2)-; alpha-D-Man-(1right3)-beta-D-Man-(1right4)-beta-D-GlcNAc-(1ri; ght4)-D-GlcNAc in which the manno syl residue nearest the reducing end has the branched trisaccharide alpha-D-Man-(1right3)-[alpha-D-Man-(1right6)]-alpha-D-Man attached at position 6. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:82646

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.700
Molar Refractivity: 329.8±0.4 cm3
#H bond acceptors: 48
#H bond donors: 29
#Freely Rotating Bonds: 27
#Rule of 5 Violations: 3
ACD/LogP: -9.44
ACD/LogD (pH 5.5): -10.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -10.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 761 Å2
Polarizability: 130.8±0.5 10-24cm3
Surface Tension: 127.6±5.0 dyne/cm
Molar Volume: 853.6±5.0 cm3

Click to predict properties on the Chemicalize site






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