ChemSpider 2D Image | Biotinyl-5'-AMP | C20H28N7O9PS


  • Molecular FormulaC20H28N7O9PS
  • Average mass573.517 Da
  • Monoisotopic mass573.140686 Da
  • ChemSpider ID4484167
  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

4130-20-5 [RN]
5'-O-[Hydroxy({5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoyl}oxy)phosphoryl]adenosin [German] [ACD/IUPAC Name]
5'-O-[Hydroxy({5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thiéno[3,4-d]imidazol-4-yl]pentanoyl}oxy)phosphoryl]adénosine [French] [ACD/IUPAC Name]
Biotinyl 5′-AMP
(+)-Biotinyl 5'-adenylate
5'-Adenylic acid anhydride with biotin
5'-Adenylic acid monoanhydride with biotin
5'-O-[hydroxy({5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoyl}oxy)phosphoryl]adenosine [ACD/IUPAC Name]
adenosine, 5'-O-[[[5-[(3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl]-1-oxopentyl]oxy]hydroxyphosphinyl]- [ACD/Index Name]

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

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

Density: 2.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.866
Molar Refractivity: 127.1±0.5 cm3
#H bond acceptors: 16
#H bond donors: 7
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: -1.04
ACD/LogD (pH 5.5): -4.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 268 Å2
Polarizability: 50.4±0.5 10-24cm3
Surface Tension: 108.6±7.0 dyne/cm
Molar Volume: 280.6±7.0 cm3

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