5MU

5-METHYLURIDINE 5'-MONOPHOSPHATE

Created: 1999-07-08
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count37
Chiral Atom Count4
Bond Count38
Aromatic Bond Count0
2D diagram of 5MU

Chemical Component Summary

Name5-METHYLURIDINE 5'-MONOPHOSPHATE
Systematic Name (OpenEye OEToolkits)[(2R,3S,4R,5R)-3,4-dihydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)oxolan-2-yl]methyl dihydrogen phosphate
FormulaC10 H15 N2 O9 P
Molecular Weight338.208
TypeRNA LINKING

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=C1NC(=O)N(C=C1C)C2OC(C(O)C2O)COP(=O)(O)O
SMILESCACTVS3.341CC1=CN([CH]2O[CH](CO[P](O)(O)=O)[CH](O)[CH]2O)C(=O)NC1=O
SMILESOpenEye OEToolkits1.5.0CC1=CN(C(=O)NC1=O)C2C(C(C(O2)COP(=O)(O)O)O)O
Canonical SMILESCACTVS3.341 CC1=CN([C@@H]2O[C@H](CO[P](O)(O)=O)[C@@H](O)[C@H]2O)C(=O)NC1=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)O
InChIInChI1.03 InChI=1S/C10H15N2O9P/c1-4-2-12(10(16)11-8(4)15)9-7(14)6(13)5(21-9)3-20-22(17,18)19/h2,5-7,9,13-14H,3H2,1H3,(H,11,15,16)(H2,17,18,19)/t5-,6-,7-,9-/m1/s1
InChIKeyInChI1.03 IGWHDMPTQKSDTL-JXOAFFINSA-N

Drug Info: DrugBank

DrugBank IDDB04243 
NameTMP
Groups experimental
Synonyms
  • 5-methyluridine 5'-monophosphate
  • ribosylthymidine 5'-monophosphate
  • rTMP
  • TMP
  • 5-methyluridine 5'-phosphate
Categories
  • Deoxyribonucleotides
  • Nucleic Acids, Nucleotides, and Nucleosides
  • Nucleotides
  • Pyrimidine Nucleotides
  • Pyrimidines

Drug Targets

NameTarget SequencePharmacological ActionActions
Single-stranded DNA-binding proteinMASRGVNKVILVGNLGQDPEVRYMPNGGAVANITLATSESWRDKATGEMK...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 12803287
ChEMBL CHEMBL1230421
ChEBI CHEBI:77120