UEP

6-ethyluridine 5'-phosphate

Created: 2008-10-23
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count40
Chiral Atom Count4
Bond Count41
Aromatic Bond Count0
2D diagram of UEP

Chemical Component Summary

Name6-ethyluridine 5'-phosphate
Synonyms6-ethyl-UMP
Systematic Name (OpenEye OEToolkits)[(2R,3S,4R,5R)-5-(6-ethyl-2,4-dioxo-pyrimidin-1-yl)-3,4-dihydroxy-oxolan-2-yl]methyl dihydrogen phosphate
FormulaC11 H17 N2 O9 P
Molecular Weight352.234
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=C1NC(=O)N(C(=C1)CC)C2OC(C(O)C2O)COP(=O)(O)O
SMILESCACTVS3.341CCC1=CC(=O)NC(=O)N1[CH]2O[CH](CO[P](O)(O)=O)[CH](O)[CH]2O
SMILESOpenEye OEToolkits1.5.0CCC1=CC(=O)NC(=O)N1C2C(C(C(O2)COP(=O)(O)O)O)O
Canonical SMILESCACTVS3.341 CCC1=CC(=O)NC(=O)N1[C@@H]2O[C@H](CO[P](O)(O)=O)[C@@H](O)[C@H]2O
Canonical SMILESOpenEye OEToolkits1.5.0 CCC1=CC(=O)NC(=O)N1[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O
InChIInChI1.03 InChI=1S/C11H17N2O9P/c1-2-5-3-7(14)12-11(17)13(5)10-9(16)8(15)6(22-10)4-21-23(18,19)20/h3,6,8-10,15-16H,2,4H2,1H3,(H,12,14,17)(H2,18,19,20)/t6-,8-,9-,10-/m1/s1
InChIKeyInChI1.03 SVESMKHPINYNGL-PEBGCTIMSA-N

Related Resource References

Resource NameReference
PubChem 49867790