ChemSpider 2D Image | 6-Deoxy-alpha-D-mannopyranosyl-(1->2)-6-deoxy-alpha-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyl-2,6,10,14,1 8,22,26,30,34,38,42-tetratetracontaundecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-D-glucopyranose | C75H123NO20P2

6-Deoxy-α-D-mannopyranosyl-(1->2)-6-deoxy-α-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyl-2,6,10,14,1 8,22,26,30,34,38,42-tetratetracontaundecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-D-glucopyranose

  • Molecular FormulaC75H123NO20P2
  • Average mass1420.722 Da
  • Monoisotopic mass1419.812500 Da
  • ChemSpider ID26332601

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

    defined stereocentres - 14 of 15 defined stereocentres

More details:

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

6-Deoxy-α-D-mannopyranosyl-(1->2)-6-deoxy-α-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyl-2,6,10,14,1 8,22,26,30,34,38,42-tetratetracontaundecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-D-glucopyranose [ACD/IUPAC Name]
6-Desoxy-α-D-mannopyranosyl-(1->2)-6-desoxy-α-D-mannopyranosyl-(1->4)-2-acetamido-2-desoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyl-2,6,10,1 4,18,22,26,30,34,38,42-tetratetracontaundecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-D-glucopyranose [German] [ACD/IUPAC Name]
6-Désoxy-α-D-mannopyranosyl-(1->2)-6-désoxy-α-D-mannopyranosyl-(1->4)-2-acétamido-2-désoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undécaméthyl-2,6,10,1 4,18,22,26,30,34,38,42-tétratétracontaundécaén-1-yl]oxy}phosphinato)oxy]phosphinato}-D-glucopyranose [French] [ACD/IUPAC Name]
D-Glucopyranose, O-6-deoxy-α-D-mannopyranosyl-(1->2)-O-6-deoxy-α-D-mannopyranosyl-(1->4)-2-(acetylamino)-2-deoxy-1-O-[hydroxy[[hydroxy[[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23, 27,31,35,39,43-undecamethyl-2,6,10,14,18,22,26,30,34,38,42-tetratetracontaundecaen-1-yl]oxy]phosphinyl]oxy]phosphinyl]-, ion(2-) [ACD/Index Name]
missing
rhamnose-(α1,2)-rhamnose-(α1,4)-N-acetylglucosamine pyrophosphorylundecaprenol
α-D-Rha-(1->2)-α-D-Rha-(1->4)-D-GlcNAc undecaprenyl diphosphate
α-D-Rha-(1->2)-α-D-Rha-(1->4)-D-GlcNAc undecaprenyl diphosphate(2-)
α-D-rhamnosyl-(1->2)-α-D-rhamnosyl-(1->4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate
α-D-rhamnosyl-(1->2)-α-D-rhamnosyl-(1->4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate(2-)
More...
  • Miscellaneous

    • Chemical Class:

      A doubly-charged organophosphate oxoanion resulting from the removal of two protons from the diphosphate group of alpha-D-rhamnosyl-(1->2)-alpha-D-rhamnosyl-(1->4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate ChEBI CHEBI:62257
      A doubly-charged organophosphate oxoanion resulting from the removal of two protons from the diphosphate group of alpha-D-rhamnosyl-(1right2)-a; lpha-D-rhamnosyl-(1right4)-N-acetyl-D-glucosaminyl unde caprenyl diphosphate ChEBI CHEBI:62257

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 21
#H bond donors: 10
#Freely Rotating Bonds: 43
#Rule of 5 Violations: 4
ACD/LogP: 20.08
ACD/LogD (pH 5.5): 9.63
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 36724.48
ACD/LogD (pH 7.4): 9.62
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 36248.93
Polar Surface Area: 344 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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