ChemSpider 2D Image | adenylate-3'-phosphate-[[2'-deoxy-uridine-5'-phosphate]-3'-phosphate] | C19H27N7O20P4

adenylate-3'-phosphate-[[2'-deoxy-uridine-5'-phosphate]-3'-phosphate]

  • Molecular FormulaC19H27N7O20P4
  • Average mass797.348 Da
  • Monoisotopic mass797.026123 Da
  • ChemSpider ID395017
  • defined stereocentres - 7 of 7 defined stereocentres


More details:






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

[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydro-2-furanyl]methyl (2R,3S,5R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2-[(phosphonooxy)methyl]tetrahydro-3-furanyl dihyd rogen diphosphate [ACD/IUPAC Name]
[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydro-2-furanyl]methyl-(2R,3S,5R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2-[(phosphonooxy)methyl]tetrahydro-3-furanyldihydr ogendiphosphat [German] [ACD/IUPAC Name]
adenylate-3'-phosphate-[[2'-deoxy-uridine-5'-phosphate]-3'-phosphate]
Dihydrogénodiphosphate de [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tétrahydro-2-furanyl]méthyle et de (2R,3S,5R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2-[(phosphonooxy) méthyl]tétrahydro-3-furanyle [French] [ACD/IUPAC Name]
PUA
U-PI-A-PI

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

PH7 [DBID]

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: 1.876
Molar Refractivity: 147.6±0.5 cm3
#H bond acceptors: 27
#H bond donors: 10
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: -6.07
ACD/LogD (pH 5.5): -14.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -15.88
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 433 Å2
Polarizability: 58.5±0.5 10-24cm3
Surface Tension: 168.3±7.0 dyne/cm
Molar Volume: 323.5±7.0 cm3

Click to predict properties on the Chemicalize site






Advertisement