CHEBI:27596 - N^π-methyl-L-histidine

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ChEBI Name Nπ-methyl-L-histidine ChEBI ID CHEBI:27596 ChEBI ASCII Name N(pros)-methyl-L-histidine Definition A L-histidine derivative that is L-histidine substituted by a methyl group at position 3 on the imidazole ring. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:7067, CHEBI:21445, CHEBI:19854 Supplier Information eMolecules:528999, ZINC000000895514 Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C7H11N3O2 Net Charge 0 Average Mass 169.18126 Monoisotopic Mass 169.08513 InChI InChI=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 InChIKey JDHILDINMRGULE-LURJTMIESA-N SMILES Cn1cncc1C[C@H](N)C(O)=O Metabolite of Species Details Saccharomyces cerevisiae (NCBI:txid4932) Source: yeast.sf.net See: PubMed Homo sapiens (NCBI:txid9606) See: PubMed Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) Biological Role(s): Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). View more via ChEBI Ontology ChEBI Ontology Outgoing Nπ-methyl-L-histidine (CHEBI:27596) has role Saccharomyces cerevisiae metabolite (CHEBI:75772) Nπ-methyl-L-histidine (CHEBI:27596) has role human metabolite (CHEBI:77746) Nπ-methyl-L-histidine (CHEBI:27596) is a L-histidine derivative (CHEBI:84076) Nπ-methyl-L-histidine (CHEBI:27596) is a non-proteinogenic L-α-amino acid (CHEBI:83822) Nπ-methyl-L-histidine (CHEBI:27596) is tautomer of Nπ-methyl-L-histidine zwitterion (CHEBI:143076) Incoming Nπ-methyl-L-histidine residue (CHEBI:43903) is substituent group from Nπ-methyl-L-histidine (CHEBI:27596) Nπ-methyl-L-histidine zwitterion (CHEBI:143076) is tautomer of Nπ-methyl-L-histidine (CHEBI:27596) IUPAC Name Nπ-methyl-L-histidine Synonyms Sources (2S)-2-amino-3-(1-methyl-1H-imidazol-5-yl)propanoic acid IUPAC 1-Methylhistidine Note: (2014-08-28) A misnomer. KEGG COMPOUND 3-Methyl-L-histidine HMDB 3-methylhistidine ChemIDplus 3-Methylhistidine KEGG COMPOUND N(pai)-Methyl-L-histidine KEGG COMPOUND N-pros-Methyl-L-histidine KEGG COMPOUND Tau-methylhistidine HMDB Manual Xrefs Databases C01152 KEGG COMPOUND HMDB0000479 HMDB MHS PDBeChem View more database links Registry Numbers Types Sources 1568650 Gmelin Registry Number Gmelin 368-16-1 CAS Registry Number ChemIDplus 83651 Reaxys Registry Number Reaxys Citations Last Modified 21 January 2016