ChemSpider 2D Image | (S)-NADPHX(4-) | C21H28N7O18P3

(S)-NADPHX(4-)

  • Molecular FormulaC21H28N7O18P3
  • Average mass759.407 Da
  • Monoisotopic mass759.072571 Da
  • ChemSpider ID27471371
  • Charge - Charge

    defined stereocentres - 9 of 9 defined stereocentres


More details:






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

(S)-NADPHX(4-)
(S)-NADPHX
(6S)-6&β;-hydroxy-1,4,5,6-tetrahydronicotinamide-adenine dinucleotide phosphate
(6S)-6β-hydroxy-1,4,5,6-tetrahydronicotinamide adenine dinucleotide phosphate
(6S)-NADPHX

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

CHEBI:64076 [DBID]
  • Miscellaneous
    • Chemical Class:

      A quadruply-charged nucleotide-sugar oxoanion obtained by deprotonation of the diphosphate OH groups of (S)-NADPHX; major species at pH 7.3. ChEBI CHEBI:64076

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

Density:
Boiling Point: 1206.3±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 187.6±3.0 kJ/mol
Flash Point: 683.4±37.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 25
#H bond donors: 12
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: -4.67
ACD/LogD (pH 5.5): -11.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -12.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 425 Å2
Polarizability:
Surface Tension:
Molar Volume:

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