ChemSpider 2D Image | NADH(2-) | C21H27N7O14P2

NADH(2-)

  • Molecular FormulaC21H27N7O14P2
  • Average mass663.426 Da
  • Monoisotopic mass663.110229 Da
  • ChemSpider ID10239197
  • Charge - Charge

    defined stereocentres - 8 of 8 defined stereocentres


More details:






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

NADH(2-)
[5-(6-Aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [[5-(3-carbamoyl-4H-pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] hydrogen phosphate
3869564
adenosine 5'-{3-[1-(3-carbamoyl-1,4-dihydropyridin-1-yl)-1,4-anhydro-D-ribitol-5-yl] diphosphate}
NADH dianion
Nicotinamide adenine dinucleotide reduced
Nicotinamide adenine dinucleotide, reduced form
Reduced nicotinamide adenine dinucleotide

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

CHEBI:57945 [DBID]
nchembio.62-comp9 [DBID]
nchembio.94-comp28 [DBID]

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

Density:
Boiling Point: 1081.8±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 166.2±3.0 kJ/mol
Flash Point: 608.0±37.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 21
#H bond donors: 10
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: -4.35
ACD/LogD (pH 5.5): -9.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -9.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 343 Å2
Polarizability:
Surface Tension:
Molar Volume:

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