ChemSpider 2D Image | 5'-O-{Hydroxy[(hydroxy{[(2R,3S)-2,3,4-trihydroxy-3-methyl(1,2,4-~13~C_3_)butyl]oxy}phosphoryl)oxy]phosphoryl}cytidine | C1113C3H25N3O14P2

5'-O-{Hydroxy[(hydroxy{[(2R,3S)-2,3,4-trihydroxy-3-methyl(1,2,4-13C3)butyl]oxy}phosphoryl)oxy]phosphoryl}cytidine

  • Molecular FormulaC1113C3H25N3O14P2
  • Average mass524.286 Da
  • Monoisotopic mass524.091248 Da
  • ChemSpider ID10163806

  • defined stereocentres - 6 of 6 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

5'-O-{Hydroxy[(hydroxy{[(2R,3S)-2,3,4-trihydroxy-3-methyl(1,2,4-13C3)butyl]oxy}phosphoryl)oxy]phosphoryl}cytidin [German] [ACD/IUPAC Name]
5'-O-{Hydroxy[(hydroxy{[(2R,3S)-2,3,4-trihydroxy-3-methyl(1,2,4-13C3)butyl]oxy}phosphoryl)oxy]phosphoryl}cytidine [ACD/IUPAC Name]
5'-O-{Hydroxy[(hydroxy{[(2R,3S)-2,3,4-trihydroxy-3-méthyl(1,2,4-13C3)butyl]oxy}phosphoryl)oxy]phosphoryl}cytidine [French] [ACD/IUPAC Name]
Cytidine, 5'-O-[hydroxy[[hydroxy[[(2R,3S)-2,3,4-trihydroxy-3-methylbutyl-1,2,4-13C3]oxy]phosphinyl]oxy]phosphinyl]- [ACD/Index Name]

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: 1.697
Molar Refractivity: 99.0±0.5 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 109.4±7.0 dyne/cm
Molar Volume: 257.1±7.0 cm3

Click to predict properties on the Chemicalize site


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