ChemSpider 2D Image | 4-Amino-1-{5-O-[(S)-hydroxy{[(S)-hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl]-alpha-L-lyxofuranosyl}-2(1H)-pyrimidinone | C9H16N3O14P3

4-Amino-1-{5-O-[(S)-hydroxy{[(S)-hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl]-α-L-lyxofuranosyl}-2(1H)-pyrimidinone

  • Molecular FormulaC9H16N3O14P3
  • Average mass483.156 Da
  • Monoisotopic mass482.984497 Da
  • ChemSpider ID61713219

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

1-[5-O-(Hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-α-L-lyxofuranosyl]-4-imino-3,4-dihydro-2(1H)-pyrimidinon [German] [ACD/IUPAC Name]
1-[5-O-(Hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-α-L-lyxofuranosyl]-4-imino-3,4-dihydro-2(1H)-pyrimidinone [ACD/IUPAC Name]
1-[5-O-(Hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-α-L-lyxofuranosyl]-4-imino-3,4-dihydro-2(1H)-pyrimidinone [French] [ACD/IUPAC Name]
2(1H)-Pyrimidinone, 3,4-dihydro-1-[5-O-[hydroxy[[hydroxy(phosphonooxy)phosphinyl]oxy]phosphinyl]-α-L-lyxofuranosyl]-4-imino- [ACD/Index Name]
2(1H)-Pyrimidinone, 4-amino-1-[5-O-[(S)-hydroxy[[(S)-hydroxy(phosphonooxy)phosphinyl]oxy]phosphinyl]-α-L-lyxofuranosyl]- [ACD/Index Name]
4-Amino-1-{5-O-[(S)-hydroxy{[(S)-hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl]-α-L-lyxofuranosyl}-2(1H)-pyrimidinon [German] [ACD/IUPAC Name]
4-Amino-1-{5-O-[(S)-hydroxy{[(S)-hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl]-α-L-lyxofuranosyl}-2(1H)-pyrimidinone [ACD/IUPAC Name]
4-Amino-1-{5-O-[(S)-hydroxy{[(S)-hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl]-α-L-lyxofuranosyl}-2(1H)-pyrimidinone [French] [ACD/IUPAC Name]
CTP
CYTIDINE-5'-TRIPHOSPHATE

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

Density: 2.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.801
Molar Refractivity: 82.5±0.5 cm3
#H bond acceptors: 17
#H bond donors: 8
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -6.01
ACD/LogD (pH 5.5): -11.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -11.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 295 Å2
Polarizability: 32.7±0.5 10-24cm3
Surface Tension: 177.3±7.0 dyne/cm
Molar Volume: 192.8±7.0 cm3

Click to predict properties on the Chemicalize site


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