Chemical Component Summary

NameN1-METHYLATED HISTIDINE
Identifiers(2S)-2-amino-3-(3-methylimidazol-4-yl)propanoic acid
FormulaC7 H11 N3 O2
Molecular Weight169.181
TypeL-PEPTIDE LINKING
Isomeric SMILESCn1cncc1C[C@@H](C(=O)O)N
InChIInChI=1S/C7H11N3O2/c1-10-4-9-3-5(10)2-6(8)7(11)12/h3-4,6H,2,8H2,1H3,(H,11,12)/t6-/m0/s1
InChIKeyJDHILDINMRGULE-LURJTMIESA-N

Chemical Details

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

Related Resource References

Resource NameReference
PubChem 6971061, 64969
ChEBI CHEBI:143076, CHEBI:27596