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Search term: InChIKey=AMPUNKYTTFDUHI-PNHWDRBUSA-L (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 5-carboxymethylaminomethyl-2-thiouridine 5'-monophosphate | C12H18N3O10PS

5-carboxymethylaminomethyl-2-thiouridine 5'-monophosphate

  • Molecular FormulaC12H18N3O10PS
  • Average mass427.324 Da
  • Monoisotopic mass427.045044 Da
  • ChemSpider ID58154722

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

5-carboxymethylaminomethyl-2-thiouridine 5'-monophosphate
Glycine, N-[[1,2,3,4-tetrahydro-4-oxo-1-(5-O-phosphono-β-D-ribofuranosyl)-2-thioxo-5-pyrimidinyl]methyl]- [ACD/Index Name]
N-{[4-Oxo-1-(5-O-phosphono-β-D-ribofuranosyl)-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinyl]methyl}glycin [German] [ACD/IUPAC Name]
N-{[4-Oxo-1-(5-O-phosphono-β-D-ribofuranosyl)-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinyl]methyl}glycine [ACD/IUPAC Name]
N-{[4-Oxo-1-(5-O-phosphono-β-D-ribofuranosyl)-2-thioxo-1,2,3,4-tétrahydro-5-pyrimidinyl]méthyl}glycine [French] [ACD/IUPAC Name]
cmnm(5)s(2)UMP
N-{[4-oxo-1-(5-O-phosphono-β-D-ribofuranosyl)-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-5-yl]methyl}glycine

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

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.704
Molar Refractivity: 89.5±0.4 cm3
#H bond acceptors: 13
#H bond donors: 7
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -1.36
ACD/LogD (pH 5.5): -5.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 240 Å2
Polarizability: 35.5±0.5 10-24cm3
Surface Tension: 120.3±5.0 dyne/cm
Molar Volume: 230.8±5.0 cm3

Click to predict properties on the Chemicalize site


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