ChemSpider 2D Image | DIGUANOSINE-PENTAPHOSPHATE | C20H29N10O24P5

DIGUANOSINE-PENTAPHOSPHATE

  • Molecular FormulaC20H29N10O24P5
  • Average mass948.366 Da
  • Monoisotopic mass948.004395 Da
  • ChemSpider ID4484327
  • defined stereocentres - 8 of 8 defined stereocentres


More details:






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

DIGUANOSINE-PENTAPHOSPHATE
[(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy({[({[(2S,3R,4S,5S)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy(hydroxy)phosphoryl}oxy(hydroxy)phosphoryl)oxy(hydroxy)phosphoryl]oxy(hydroxy)phosphoryl}oxy
{[(2S,3R,4S,5S)-5-(2-amino-6-oxo-6,9-dihydro-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}[({[({[({[(2R,3S,4R,5R)-5-(2-amino-6-oxo-6,9-dihydro-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl)oxy]phosphinic acid
78101-73-2 [RN]
diguanosine pentaphosphate
GP5

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

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

Density: 2.8±0.1 g/cm3
Boiling Point: 1416.0±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 225.9±3.0 kJ/mol
Flash Point: 810.2±37.1 °C
Index of Refraction: 2.008
Molar Refractivity: 168.5±0.5 cm3
#H bond acceptors: 34
#H bond donors: 15
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: -6.79
ACD/LogD (pH 5.5): -15.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -15.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 561 Å2
Polarizability: 66.8±0.5 10-24cm3
Surface Tension: 228.9±7.0 dyne/cm
Molar Volume: 335.3±7.0 cm3

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