ChemSpider 2D Image | ent-NADPH | C21H30N7O17P3

ent-NADPH

  • Molecular FormulaC21H30N7O17P3
  • Average mass745.421 Da
  • Monoisotopic mass745.091125 Da
  • ChemSpider ID17215925
  • defined stereocentres - 8 of 8 defined stereocentres


More details:






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

53-57-6 [RN]
ent-NADPH
2'-(dihydrogen phosphate) 5'-(trihydrogen pyrophosphate) Adenosine 5'-ester with 1,4-dihydro-1-b-D-ribofuranosylnicotinamide
2'-(dihydrogen phosphate) 5'-(trihydrogen pyrophosphate) Adenosine 5'-ester with 1,4-dihydro-1-β-δ-ribofuranosylnicotinamide
Adenosine 5'-(trihydrogen diphosphate) 2'-(dihydrogen phosphate) P'-5'-ester with 1,4-dihydro-1-β-D-ribofuranosyl-3-pyridinecarboxamide
Adenosine 5'-(trihydrogen diphosphate) 2'-(dihydrogen phosphate) P'-5'-ester with 1,4-dihydro-1-β-δ-ribofuranosyl-3-pyridinecarboxamide
b-NADPH
b-Nicotinamide-adenine-dinucleotide-phosphorate
b-Nicotinamide-adenine-dinucleotide-phosphoric acid
Dihydrocodehydrogenase II
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density: 2.3±0.1 g/cm3
Boiling Point: 1175.1±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 182.1±3.0 kJ/mol
Flash Point: 664.5±37.1 °C
Index of Refraction: 1.849
Molar Refractivity: 145.8±0.5 cm3
#H bond acceptors: 24
#H bond donors: 11
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: -5.93
ACD/LogD (pH 5.5): -12.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -12.86
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 394 Å2
Polarizability: 57.8±0.5 10-24cm3
Surface Tension: 142.2±7.0 dyne/cm
Molar Volume: 326.4±7.0 cm3

Click to predict properties on the Chemicalize site






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