ChemSpider 2D Image | 5'-O-[({[(4-Formyl-5-hydroxy-6-methyl-3-pyridinyl)methoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]guanosine | C18H22N6O13P2

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

  • Molecular FormulaC18H22N6O13P2
  • Average mass592.347 Da
  • Monoisotopic mass592.072021 Da
  • ChemSpider ID2301982

  • defined stereocentres - 4 of 4 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)methoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]guanosin [German] [ACD/IUPAC Name]
5'-O-[({[(4-Formyl-5-hydroxy-6-methyl-3-pyridinyl)methoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]guanosine [ACD/IUPAC Name]
5'-O-[({[(4-Formyl-5-hydroxy-6-méthyl-3-pyridinyl)méthoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]guanosine [French] [ACD/IUPAC Name]
Guanosine, 5'-O-[[[[(4-formyl-5-hydroxy-6-methyl-3-pyridinyl)methoxy]hydroxyphosphinyl]oxy]hydroxyphosphinyl]- [ACD/Index Name]
117643-62-6 [RN]
GP2-PL
Guanosine 5'-(trihydrogen diphosphate), mono((4-formyl-5-hydroxy-6-methyl-3-pyridinyl)methyl) ester
Guanosine diphosphopyridoxal
Pyridoxal-5'-diphospho-5'-guanosine

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

Density: 2.1±0.1 g/cm3
Boiling Point: 1036.2±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 158.7±3.0 kJ/mol
Flash Point: 580.4±37.1 °C
Index of Refraction: 1.822
Molar Refractivity: 120.1±0.5 cm3
#H bond acceptors: 19
#H bond donors: 8
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: -1.46
ACD/LogD (pH 5.5): -6.90
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 307 Å2
Polarizability: 47.6±0.5 10-24cm3
Surface Tension: 121.6±7.0 dyne/cm
Molar Volume: 275.6±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement