2MU

2',5-DIMETHYLURIDINE-5'-MONOPHOSPHATE

Created: 2000-08-09
Last modified:  2011-06-04

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Chemical Details

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

Chemical Component Summary

Name2',5-DIMETHYLURIDINE-5'-MONOPHOSPHATE
Systematic Name (OpenEye OEToolkits)[(2R,3R,4R,5R)-3-hydroxy-4-methoxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)oxolan-2-yl]methyl dihydrogen phosphate
FormulaC11 H17 N2 O9 P
Molecular Weight352.234
TypeRNA LINKING

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=C1NC(=O)N(C=C1C)C2OC(C(O)C2OC)COP(=O)(O)O
SMILESCACTVS3.341CO[CH]1[CH](O)[CH](CO[P](O)(O)=O)O[CH]1N2C=C(C)C(=O)NC2=O
SMILESOpenEye OEToolkits1.5.0CC1=CN(C(=O)NC1=O)C2C(C(C(O2)COP(=O)(O)O)O)OC
Canonical SMILESCACTVS3.341 CO[C@@H]1[C@H](O)[C@@H](CO[P](O)(O)=O)O[C@H]1N2C=C(C)C(=O)NC2=O
Canonical SMILESOpenEye OEToolkits1.5.0 CC1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)OC
InChIInChI1.03 InChI=1S/C11H17N2O9P/c1-5-3-13(11(16)12-9(5)15)10-8(20-2)7(14)6(22-10)4-21-23(17,18)19/h3,6-8,10,14H,4H2,1-2H3,(H,12,15,16)(H2,17,18,19)/t6-,7-,8-,10-/m1/s1
InChIKeyInChI1.03 AMKCISYJIZUJJQ-FDDDBJFASA-N

Related Resource References

Resource NameReference
PubChem 49866466