ChemSpider 2D Image | dodecanoyl-AMP | C22H36N5O8P

dodecanoyl-AMP

  • Molecular FormulaC22H36N5O8P
  • Average mass529.524 Da
  • Monoisotopic mass529.230164 Da
  • ChemSpider ID25057174
  • defined stereocentres - 4 of 4 defined stereocentres


More details:






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

5'-O-[(Dodecanoyloxy)(hydroxy)phosphoryl]adenosin [German] [ACD/IUPAC Name]
5'-O-[(Dodecanoyloxy)(hydroxy)phosphoryl]adenosine [ACD/IUPAC Name]
5'-O-[(Dodecanoyloxy)(hydroxy)phosphoryl]adénosine [French] [ACD/IUPAC Name]
Adenosine, 5'-O-[hydroxy[(1-oxododecyl)oxy]phosphinyl]- [ACD/Index Name]
dodecanoyl-AMP
1ZZ
5'-O-[(S)-(Dodecanoyloxy)(Hydroxy)phosphoryl]adenosine
dodecanoyl adenylate
https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:84312
lauroyl adenylate
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  • Miscellaneous
    • Chemical Class:

      A fatty acyl-AMP that results from the formal condensation of the phosphoryl group of AMP with the carboxyl group of dodecanoic (lauric) acid. ChEBI CHEBI:84312

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

Density: 1.5±0.1 g/cm3
Boiling Point: 756.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 115.6±3.0 kJ/mol
Flash Point: 411.0±35.7 °C
Index of Refraction: 1.647
Molar Refractivity: 126.4±0.5 cm3
#H bond acceptors: 13
#H bond donors: 5
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: 3.88
ACD/LogD (pH 5.5): 0.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 202 Å2
Polarizability: 50.1±0.5 10-24cm3
Surface Tension: 65.7±7.0 dyne/cm
Molar Volume: 347.9±7.0 cm3

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