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ChemSpider 2D Image | [5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydro-2-furanyl]methyl-(3,4,5-trihydroxytetrahydro-2-furanyl)methyldihydrogen-diphosphat | C15H23N5O14P2

[5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydro-2-furanyl]methyl-(3,4,5-trihydroxytetrahydro-2-furanyl)methyldihydrogen-diphosphat

  • Molecular FormulaC15H23N5O14P2
  • Average mass559.316 Da
  • Monoisotopic mass559.071655 Da
  • ChemSpider ID187

More details:

Date of deprecation: 17:12, Apr 8, 2015
Reason for deprecation: Deprecate record: 8 undefined sterocentres

If you believe this record was deprecated in error, please use the Comment on this record button to contact the ChemSpider team.

Common reasons for deprecation are:
  • Chemically impossible structures (eg. incorrect valence atoms)
  • Lack of any linking data sources
  • Poor depiction of a structure that is already in ChemSpider

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

[5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydro-2-furanyl]methyl (3,4,5-trihydroxytetrahydro-2-furanyl)methyl dihydrogen diphosphate [ACD/IUPAC Name]
[5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydro-2-furanyl]methyl-(3,4,5-trihydroxytetrahydro-2-furanyl)methyldihydrogendiphosphat [German] [ACD/IUPAC Name]
[5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydro-2-furanyl]methyl-(3,4,5-trihydroxytetrahydro-2-furanyl)methyldihydrogen-diphosphat
Dihydrogène diphosphate de [5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytétrahydro-2-furanyl]méthyle et de (3,4,5-trihydroxytétrahydro-2-furanyl)méthyle
Dihydrogénodiphosphate de [5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytétrahydro-2-furanyl]méthyle et de (3,4,5-trihydroxytétrahydro-2-furanyl)méthyle [French] [ACD/IUPAC Name]
(Rib5)ppA
[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy[hydroxy(3,4,5-trihydroxyoxolan-2-yl)methoxyphosphoryl]oxyphosphinic acid
[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [hydroxy-[(3,4,5-trihydroxyoxolan-2-yl)methoxy]phosphoryl] hydrogen phosphate
5-(adenosine 5'-pyrophosphoryl)-D-ribose
A5'pp5Rib
More...

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

Density: 2.4±0.1 g/cm3
Boiling Point: 956.5±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 145.9±3.0 kJ/mol
Flash Point: 532.3±37.1 °C
Index of Refraction: 1.873
Molar Refractivity: 104.8±0.5 cm3
#H bond acceptors: 19
#H bond donors: 9
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: -3.50
ACD/LogD (pH 5.5): -9.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -9.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 311 Å2
Polarizability: 41.6±0.5 10-24cm3
Surface Tension: 150.7±7.0 dyne/cm
Molar Volume: 230.1±7.0 cm3

Click to predict properties on the Chemicalize site


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