ChemSpider 2D Image | (1xi)-1,5-Anhydro-1-[(S)-[(2S,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytetrahydro-2-furanyl]{[hydroxy(phosphonooxy)phosphoryl]oxy}methyl]-D-mannitol | C15H24N2O17P2

(1ξ)-1,5-Anhydro-1-[(S)-[(2S,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytetrahydro-2-furanyl]{[hydroxy(phosphonooxy)phosphoryl]oxy}methyl]-D-mannitol

  • Molecular FormulaC15H24N2O17P2
  • Average mass566.302 Da
  • Monoisotopic mass566.054993 Da
  • ChemSpider ID2339581
  • defined stereocentres - 8 of 10 defined stereocentres


More details:






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

(1ξ)-1,5-Anhydro-1-[(S)-[(2S,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytetrahydro-2-furanyl]{[hydroxy(phosphonooxy)phosphoryl]oxy}methyl]-D-mannitol [ACD/IUPAC Name]
(1ξ)-1,5-Anhydro-1-[(S)-[(2S,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytetrahydro-2-furanyl]{[hydroxy(phosphonooxy)phosphoryl]oxy}methyl]-D-mannitol [German] [ACD/IUPAC Name]
(1ξ)-1,5-Anhydro-1-[(S)-[(2S,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytétrahydro-2-furanyl]{[hydroxy(phosphonooxy)phosphoryl]oxy}méthyl]-D-mannitol [French] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 1-[(6ξ)-6,10-anhydro-5-O-[hydroxy(phosphonooxy)phosphinyl]-D-manno-α-L-talo-undecofuranosyl]- [ACD/Index Name]
16375-64-7 [RN]
20235-46-5 [RN]
32369-14-5 [RN]
AC1MIY64
Uridine 5'-(trihydrogen diphosphate), P'-α-D-mannopyranosyl ester

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

Density: 2.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.688
Molar Refractivity: 106.6±0.3 cm3
#H bond acceptors: 19
#H bond donors: 10
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: -5.12
ACD/LogD (pH 5.5): -10.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -10.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 322 Å2
Polarizability: 42.3±0.5 10-24cm3
Surface Tension: 134.5±3.0 dyne/cm
Molar Volume: 279.4±3.0 cm3

Click to predict properties on the Chemicalize site






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