ChemSpider 2D Image | P(1)-(5'-adenosyl),P(4)-(5'-guanosyl) tetraphosphate | C20H28N10O20P4

P(1)-(5'-adenosyl),P(4)-(5'-guanosyl) tetraphosphate

  • Molecular FormulaC20H28N10O20P4
  • Average mass852.386 Da
  • Monoisotopic mass852.043152 Da
  • ChemSpider ID8947177

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

P(1)-(5'-adenosyl),P(4)-(5'-guanosyl) tetraphosphate
[(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy[({[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy(hydroxy)phosphoryl}oxy(hydroxy)phosphoryl)oxy(hydroxy)phosphoryl]oxyphosphinic acid
{[(2R,3S,4R,5R)-5-(2-amino-6-oxo-6,9-dihydro-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({[({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]oxy})phosphinic acid
100849-67-0 [RN]
A(5')p4(5')G
adenosine(5')tetraphospho(5')guanosine
Guanosine 5'-(pentahydrogen tetraphosphate), 5'->3'-ester with adenosine
Guanosine tetraphosphate adenosine
P1-(5'-ADENOSYL)-P5-(5'-GUANOSYL) PENTAPHOSPHATE

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

7564565 [DBID]
  • Miscellaneous

    • Chemical Class:

      A purine ribonucleoside 5'-tetraphosphate compound having a 5'-adenosyl residue at the <element>P</element><smallsup>1</smallsup>-position and a 5'-guanosyl residue at the <element>P</element><smallsu p>4</smallsup>-position. ChEBI CHEBI:52968
      A purine ribonucleoside 5'-tetraphosphate compound having a 5'-adenosyl residue at the P(1)-position and a 5'-guanosyl residue at the P(4)-position. ChEBI CHEBI:52968

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

Density: 2.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.993
Molar Refractivity: 157.7±0.5 cm3
#H bond acceptors: 30
#H bond donors: 13
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: -5.31
ACD/LogD (pH 5.5): -13.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -13.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 489 Å2
Polarizability: 62.5±0.5 10-24cm3
Surface Tension: 202.6±7.0 dyne/cm
Molar Volume: 317.0±7.0 cm3

Click to predict properties on the Chemicalize site


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