ChemSpider 2D Image | 5'-O-([(4-Formyl-5-hydroxy-6-methyl-3-pyridinyl)(hydroxy)methyl]{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)uridine | C17H22N3O17P3

5'-O-([(4-Formyl-5-hydroxy-6-methyl-3-pyridinyl)(hydroxy)methyl]{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)uridine

  • Molecular FormulaC17H22N3O17P3
  • Average mass633.288 Da
  • Monoisotopic mass633.016174 Da
  • ChemSpider ID116493

  • defined stereocentres - 4 of 6 defined stereocentres

More details:

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

5'-O-([(4-Formyl-5-hydroxy-6-methyl-3-pyridinyl)(hydroxy)methyl]{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)uridin [German] [ACD/IUPAC Name]
5'-O-([(4-Formyl-5-hydroxy-6-methyl-3-pyridinyl)(hydroxy)methyl]{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)uridine [ACD/IUPAC Name]
5'-O-([(4-Formyl-5-hydroxy-6-méthyl-3-pyridinyl)(hydroxy)méthyl]{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)uridine [French] [ACD/IUPAC Name]
Uridine, 5'-O-[[(4-formyl-5-hydroxy-6-methyl-3-pyridinyl)hydroxymethyl][[hydroxy(phosphonooxy)phosphinyl]oxy]phosphinyl]- [ACD/Index Name]
135145-98-1 [RN]
Uridine 5'-(tetrahydrogen triphosphate), P''-((4-formyl-5-hydroxy-6-methyl-3-pyridinyl)methyl) ester
Uridine triphosphopyridoxal
Utp-PL

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

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.681
Molar Refractivity: 123.9±0.3 cm3
#H bond acceptors: 20
#H bond donors: 8
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: -4.97
ACD/LogD (pH 5.5): -9.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -10.65
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 339 Å2
Polarizability: 49.1±0.5 10-24cm3
Surface Tension: 119.0±3.0 dyne/cm
Molar Volume: 327.4±3.0 cm3

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