ChemSpider 2D Image | GDP-alpha-D-mannuronic acid | C16H23N5O17P2

GDP-α-D-mannuronic acid

  • Molecular FormulaC16H23N5O17P2
  • Average mass619.325 Da
  • Monoisotopic mass619.056396 Da
  • ChemSpider ID394330
  • defined stereocentres - 9 of 9 defined stereocentres


More details:






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

(2S,3S,4S,5S,6R)-6-{[{[{[(2R,3S,4R,5R)-5-(2-Amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3,4-dihydroxytetrahydro-2-furanyl]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]oxy}-3,4,5-trihydroxytetrahydro -2H-pyran-2-carbonsäure [German] [ACD/IUPAC Name]
(2S,3S,4S,5S,6R)-6-{[{[{[(2R,3S,4R,5R)-5-(2-Amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3,4-dihydroxytetrahydro-2-furanyl]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]oxy}-3,4,5-trihydroxytetrahydro -2H-pyran-2-carboxylic acid [ACD/IUPAC Name]
Acide (2S,3S,4S,5S,6R)-6-{[{[{[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3,4-dihydroxytétrahydro-2-furanyl]méthoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]oxy}-3,4,5-trihydroxytétr ahydro-2H-pyrane-2-carboxylique [French] [ACD/IUPAC Name]
GDP-α-D-mannuronic acid
1,2-HYDRO-1-OXY-3,4-HYDRO-3-(1-METHOXY-2-OXY-3,4-DIHYDROXYPENTYL)-8,9-DIHYDROXY-7-(SEC-BUTYL)-ANTHRACENE
GDP-D-mannuronic acid
GDX
GUANOSINE 5'-(TRIHYDROGEN DIPHOSPHATE), P'-D-MANNOPYRANOSYL ESTER
guanosine 5'-[3-(α-D-mannopyranosyluronic acid) dihydrogen diphosphate]
guanosine 5'-diphosphate-α-D-mannuronic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

DXA [DBID]
  • Miscellaneous
    • Chemical Class:

      A GDP-<stereo>D</stereo>-mannuronic acid in which the anomeric centre of the mannuronic acid fragment has <stereo>alpha</stereo>-configuration. ChEBI CHEBI:85507

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 2.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.916
Molar Refractivity: 112.0±0.5 cm3
#H bond acceptors: 22
#H bond donors: 11
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: -2.97
ACD/LogD (pH 5.5): -9.74
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -9.76
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 364 Å2
Polarizability: 44.4±0.5 10-24cm3
Surface Tension: 172.5±7.0 dyne/cm
Molar Volume: 237.8±7.0 cm3

Click to predict properties on the Chemicalize site






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