ChemSpider 2D Image | 5'-O-[({(2S)-2-Amino-5-[(diaminomethylene)amino]pentanoyl}oxy)(hydroxy)phosphoryl]adenosine | C16H26N9O8P

5'-O-[({(2S)-2-Amino-5-[(diaminomethylene)amino]pentanoyl}oxy)(hydroxy)phosphoryl]adenosine

  • Molecular FormulaC16H26N9O8P
  • Average mass503.407 Da
  • Monoisotopic mass503.164185 Da
  • ChemSpider ID2339572

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

5'-O-[({(2S)-2-Amino-5-[(diaminomethylen)amino]pentanoyl}oxy)(hydroxy)phosphoryl]adenosin [German] [ACD/IUPAC Name]
5'-O-[({(2S)-2-Amino-5-[(diaminomethylene)amino]pentanoyl}oxy)(hydroxy)phosphoryl]adenosine [ACD/IUPAC Name]
5'-O-[({(2S)-2-Amino-5-[(diaminométhylène)amino]pentanoyl}oxy)(hydroxy)phosphoryl]adénosine [French] [ACD/IUPAC Name]
Adenosine, 5'-O-[[[(2S)-2-amino-5-[(diaminomethylene)amino]-1-oxopentyl]oxy]hydroxyphosphinyl]- [ACD/Index Name]
15470-08-3 [RN]
Arginyl adenylate
L-Arginine, monoanhydride with 5'-adenylic acid
L-Arginine,monoanhydride with 5'-adenylic acid (9CI)

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

Density: 2.0±0.1 g/cm3
Boiling Point: 877.4±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 133.6±3.0 kJ/mol
Flash Point: 484.4±37.1 °C
Index of Refraction: 1.821
Molar Refractivity: 107.8±0.5 cm3
#H bond acceptors: 17
#H bond donors: 11
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: -2.44
ACD/LogD (pH 5.5): -6.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 292 Å2
Polarizability: 42.7±0.5 10-24cm3
Surface Tension: 113.7±7.0 dyne/cm
Molar Volume: 247.4±7.0 cm3

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