Chemical Component Summary

Name4-METHYL-HISTIDINE
Identifiers(2S)-2-amino-3-(1-methylimidazol-4-yl)propanoic acid
FormulaC7 H11 N3 O2
Molecular Weight169.181
TypeL-PEPTIDE LINKING
Isomeric SMILESCn1cc(nc1)C[C@@H](C(=O)O)N
InChIInChI=1S/C7H11N3O2/c1-10-3-5(9-4-10)2-6(8)7(11)12/h3-4,6H,2,8H2,1H3,(H,11,12)/t6-/m0/s1
InChIKeyBRMWTNUJHUMWMS-LURJTMIESA-N

Chemical Details

Formal Charge0
Atom Count23
Chiral Atom Count1
Bond Count23
Aromatic Bond Count5

Drug Info: DrugBank

DrugBank IDDB04151 
Name1-Methylhistidine
Groups experimental
Synonyms
  • N(tele)-methyl-L-histidine
  • Pi-methylhistidine
  • 1-methyl-L-histidine
  • 1-Methylhistidine
  • (2S)-2-amino-3-(1-methyl-1H-imidazol-4-yl)propanoic acid
Categories
  • Amino Acids
  • Amino Acids, Cyclic
  • Amino Acids, Peptides, and Proteins
CAS number332-80-9

Drug Targets

NameTarget SequencePharmacological ActionActions
Actin, alpha skeletal muscleMCDEDETTALVCDNGSGLVKAGFAGDDAPRAVFPSIVGRPRHQGVMVGMG...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 7020397, 92105
ChEMBL CHEMBL1233327
ChEBI CHEBI:50599