ChemSpider 2D Image | ADP ribose | C15H23N5O14P2

ADP ribose

  • Molecular FormulaC15H23N5O14P2
  • Average mass559.316 Da
  • Monoisotopic mass559.071655 Da
  • ChemSpider ID28084
  • defined stereocentres - 7 of 7 defined stereocentres


More details:






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

[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydro-2-furanyl]methyl (2R,3R,4R)-2,3,4-trihydroxy-5-oxopentyl dihydrogen diphosphate [ACD/IUPAC Name]
[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydro-2-furanyl]methyl-(2R,3R,4R)-2,3,4-trihydroxy-5-oxopentyldihydrogendiphosphat [German] [ACD/IUPAC Name]
ADP ribose
Dihydrogénodiphosphate de [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytétrahydro-2-furanyl]méthyle et de (2R,3R,4R)-2,3,4-trihydroxy-5-oxopentyle [French] [ACD/IUPAC Name]
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [hydroxy-[(2R,3R,4R)-2,3,4-trihydroxy-5-oxopentoxy]phosphoryl] hydrogen phosphate
[32P]-ADP-ribose
[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [hydroxy-[(3,4,5-trihydroxyoxolan-2-yl)methox
10418-12-9 [RN]
20762-30-5,10418-12-9,21090-17-5,2140-57-0,26635-72-3,27576-48-3,28115-73-3,29352-45-2,86-06-6
21090-17-5 [RN]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 2.2±0.1 g/cm3
Boiling Point: 1007.5±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 154.0±3.0 kJ/mol
Flash Point: 563.1±37.1 °C
Index of Refraction: 1.802
Molar Refractivity: 106.9±0.5 cm3
#H bond acceptors: 19
#H bond donors: 9
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: -2.97
ACD/LogD (pH 5.5): -8.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.61
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 319 Å2
Polarizability: 42.4±0.5 10-24cm3
Surface Tension: 133.3±7.0 dyne/cm
Molar Volume: 249.5±7.0 cm3

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