ChemSpider 2D Image | 2-Acetamido-2,6-dideoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyl-2,6,10,14,18,22,26,30,34,38,42-tetratetracontaundecaen-1-yl]oxy}phosphinato)oxy]pho sphinato}-D-galactopyranose | C63H103NO11P2

2-Acetamido-2,6-dideoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyl-2,6,10,14,18,22,26,30,34,38,42-tetratetracontaundecaen-1-yl]oxy}phosphinato)oxy]pho sphinato}-D-galactopyranose

  • Molecular FormulaC63H103NO11P2
  • Average mass1112.441 Da
  • Monoisotopic mass1111.701782 Da
  • ChemSpider ID26332598

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 5 defined stereocentres

More details:

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

2-Acetamido-2,6-dideoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyl-2,6,10,14,18,22,26,30,34,38,42-tetratetracontaundecaen-1-yl]oxy}phosphinato)oxy]pho sphinato}-D-galactopyranose [ACD/IUPAC Name]
2-Acetamido-2,6-didesoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyl-2,6,10,14,18,22,26,30,34,38,42-tetratetracontaundecaen-1-yl]oxy}phosphinato)oxy]ph osphinato}-D-galactopyranose [German] [ACD/IUPAC Name]
2-Acétamido-2,6-didésoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undécaméthyl-2,6,10,14,18,22,26,30,34,38,42-tétratétracontaundécaén-1-yl]oxy}phosphinato)oxy]ph osphinato}-D-galactopyranose [French] [ACD/IUPAC Name]
D-Galactopyranose, 2-(acetylamino)-2,6-dideoxy-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-tetratetraconta undecaen-1-yl]oxy]phosphinyl]oxy]phosphinyl]-, ion(2-) [ACD/Index Name]
2-acetamido-2,6-dideoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphinato)oxy]pho
2-acetamido-2,6-dideoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-D-galactopyranose
2-acetamido-2,6-dideoxy-D-galactosyl undecaprenyl diphosphate
2-acetamido-2,6-dideoxy-D-galactosyl undecaprenyl diphosphate(2-)
N-acetyl-D-fucosaminyl undecaprenyl diphosphate
N-acetyl-D-fucosaminyl undecaprenyl diphosphate(2-)
  • Miscellaneous

    • Chemical Class:

      A doubly-charged organophosphate oxoanion resulting from the removal of two protons from the diphosphate group of N-acetyl-D-fucosaminyl undecaprenyl diphosphate; m; ajor species at pH 7.3. ChEBI CHEBI:62249
      A doubly-charged organophosphate oxoanion resulting from the removal of two protons from the diphosphate group of N-acetyl-D-fucosaminyl undecaprenyl diphosphate; major species at pH 7.3. ChEBI CHEBI:62249

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: 12
#H bond donors: 5
#Freely Rotating Bonds: 38
#Rule of 5 Violations: 4
ACD/LogP: 19.07
ACD/LogD (pH 5.5): 11.27
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 290425.75
ACD/LogD (pH 7.4): 11.27
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 284204.16
Polar Surface Area: 206 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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