ChemSpider 2D Image | N-[5-(1,2-Dithiolan-3-yl)pentanoyl]guanosine 5'-(dihydrogen phosphate) | C18H26N5O9PS2

N-[5-(1,2-Dithiolan-3-yl)pentanoyl]guanosine 5'-(dihydrogen phosphate)

  • Molecular FormulaC18H26N5O9PS2
  • Average mass551.531 Da
  • Monoisotopic mass551.090942 Da
  • ChemSpider ID35032769

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

Guanosine, N-[5-(1,2-dithiolan-3-yl)-1-oxopentyl]-, 5'-(dihydrogen phosphate) [ACD/Index Name]
N-[5-(1,2-Dithiolan-3-yl)pentanoyl]guanosin5'-(dihydrogenphosphat) [German] [ACD/IUPAC Name]
N-[5-(1,2-Dithiolan-3-yl)pentanoyl]guanosine 5'-(dihydrogen phosphate) [ACD/IUPAC Name]
N-[5-(1,2-Dithiolan-3-yl)pentanoyl]guanosine-5'-(dihydrogène phosphate) [French] [ACD/IUPAC Name]
[(2R,3S,4R,5R)-5-{2-[5-(1,2-dithiolan-3-yl)pentanamido]-6-oxo-1H-purin-9-yl}-3,4-dihydroxyoxolan-2-yl]methoxyphosphonic acid
{[(2R,3S,4R,5R)-5-{2-[5-(1,2-dithiolan-3-yl)pentanamido]-6-oxo-6,9-dihydro-1H-purin-9-yl}-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
Lipoyl-GMP

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

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

Density: 2.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.824
Molar Refractivity: 122.7±0.5 cm3
#H bond acceptors: 14
#H bond donors: 6
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: 2.38
ACD/LogD (pH 5.5): -3.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 265 Å2
Polarizability: 48.6±0.5 10-24cm3
Surface Tension: 101.9±7.0 dyne/cm
Molar Volume: 280.9±7.0 cm3

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