ChemSpider 2D Image | (1xi)-1,5-Anhydro-6-deoxy-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]-L-mannitol | C15H24N2O16P2

(1ξ)-1,5-Anhydro-6-deoxy-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]-L-mannitol

  • Molecular FormulaC15H24N2O16P2
  • Average mass550.302 Da
  • Monoisotopic mass550.060120 Da
  • ChemSpider ID2339755

  • defined stereocentres - 8 of 10 defined stereocentres

More details:

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

(1ξ)-1,5-Anhydro-6-deoxy-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]-L-mannitol [ACD/IUPAC Name]
(1ξ)-1,5-Anhydro-6-desoxy-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]-L-mannitol [German] [ACD/IUPAC Name]
(1ξ)-1,5-Anhydro-6-désoxy-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]-L-mannitol [French] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 1-[(6ξ)-6,10-anhydro-11-deoxy-5-O-[hydroxy(phosphonooxy)phosphinyl]-L-manno-α-L-talo-undecofuranosyl]- [ACD/Index Name]
30174-43-7 [RN]
URDP
Uridine 5'-(trihydrogen diphosphate), P'-(6-deoxy-L-mannopyranosyl) ester
Uridine 5'-(β-rhamnopyranosyl diphosphate)

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

Density: 2.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.671
Molar Refractivity: 105.1±0.3 cm3
#H bond acceptors: 18
#H bond donors: 9
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: -4.56
ACD/LogD (pH 5.5): -9.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -10.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 302 Å2
Polarizability: 41.7±0.5 10-24cm3
Surface Tension: 122.7±3.0 dyne/cm
Molar Volume: 280.9±3.0 cm3

Click to predict properties on the Chemicalize site


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