ChemSpider 2D Image | α-D-Glucopyranuronic acid, 2-(acetylamino)-2-deoxy-, 1→P′-ester with uridine 5′-(trihydrogen diphosphate) | C17H25N3O18P2

α-D-Glucopyranuronic acid, 2-(acetylamino)-2-deoxy-, 1→P′-ester with uridine 5′-(trihydrogen diphosphate)

  • Molecular FormulaC17H25N3O18P2
  • Average mass621.337 Da
  • Monoisotopic mass621.060852 Da
  • ChemSpider ID17229213
  • defined stereocentres - 9 of 9 defined stereocentres


More details:






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

(2S,3S,4R,5R,6R)-5-Acetamido-6-{[{[{[(2R,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytetrahydro-2-furanyl]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]oxy}-3,4-dihydroxyt etrahydro-2H-pyran-2-carbonsäure [German] [ACD/IUPAC Name]
(2S,3S,4R,5R,6R)-5-Acetamido-6-{[{[{[(2R,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytetrahydro-2-furanyl]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]oxy}-3,4-dihydroxyt etrahydro-2H-pyran-2-carboxylic acid [ACD/IUPAC Name]
24758-79-0 [RN]
Acide (2S,3S,4R,5R,6R)-5-acétamido-6-{[{[{[(2R,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytétrahydro-2-furanyl]méthoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]oxy}-3,4-dihy droxytétrahydro-2H-pyrane-2-carboxylique [French] [ACD/IUPAC Name]
α-D-Glucopyranuronic acid, 2-(acetylamino)-2-deoxy-, 1→P′-ester with uridine 5′-(trihydrogen diphosphate)
(2s,3s,4r,5r,6r)-5-Acetamido-6-[[[(2r,3s,4r,5r)-5-(2,4-Dioxopyrimidin-1-Yl)-3,4-Dihydroxy-Oxolan-2-Yl]methoxy-Hydroxy-Phosphoryl]oxy-Hydroxy-Phosphoryl]oxy-3,4-Dihydroxy-Oxane-2-Carboxylic Acid
HP7
https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:65047
UDP-2-acetamido-2-deoxy-α-D-glucuronic acid
UDP-N-acetyl-D-glucosaminuronate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.660
Molar Refractivity: 118.9±0.4 cm3
#H bond acceptors: 21
#H bond donors: 9
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: -4.81
ACD/LogD (pH 5.5): -11.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -11.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 337 Å2
Polarizability: 47.1±0.5 10-24cm3
Surface Tension: 116.8±5.0 dyne/cm
Molar Volume: 322.1±5.0 cm3

Click to predict properties on the Chemicalize site






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