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ChemSpider 2D Image | ADP-Ribosyl-L-arginine | C21H35N9O15P2

ADP-Ribosyl-L-arginine

  • Molecular FormulaC21H35N9O15P2
  • Average mass715.501 Da
  • Monoisotopic mass715.172791 Da
  • ChemSpider ID479

More details:





Date of deprecation: 15:08, Apr 10, 2015
Reason for deprecation: Deprecate record: 9 undefined stereocentres

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

ADP-Ribosyl-L-arginine
2-amino-5-[(E)-{amino[(5-{[({[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy(hydroxy)phosphoryl}oxy(hydroxy)phosphoryl)oxy]methyl}-3,4-dihydroxyoxolan-2-yl)amino]methylidene}amino]pentanoic acid
N(w)-(ADP-D-Ribosyl)-arginine
N(w)-(ADP-D-Ribosyl)-L-arginine
N(w)-(ADP-δ-Ribosyl)-arginine
N(w)-(ADP-δ-Ribosyl)-L-arginine
N(ω)-(ADP-D-ribosyl)-arginine
N(ω)-(ADP-D-ribosyl)-L-arginine
N(ω)-(ADP-δ-ribosyl)-arginine
N(ω)-(ADP-δ-ribosyl)-L-arginine
More...

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

CPD-557 [DBID]

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

Density: 2.2±0.1 g/cm3
Boiling Point: 1093.5±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 168.2±3.0 kJ/mol
Flash Point: 615.2±37.1 °C
Index of Refraction: 1.830
Molar Refractivity: 143.3±0.5 cm3
#H bond acceptors: 24
#H bond donors: 14
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: -4.13
ACD/LogD (pH 5.5): -8.73
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.94
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 405 Å2
Polarizability: 56.8±0.5 10-24cm3
Surface Tension: 128.1±7.0 dyne/cm
Molar Volume: 326.2±7.0 cm3

Click to predict properties on the Chemicalize site






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