CHEBI:16437 - N-acetyl-L-histidine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-acetyl-L-histidine
ChEBI ID CHEBI:16437
ChEBI ASCII Name N-acetyl-L-histidine
Definition A histidine derivative that is L-histidine having an acetyl substituent on the α-nitrogen.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:12462, CHEBI:7153, CHEBI:21554
Supplier Information
Download Molfile XML SDF
Formula C8H11N3O3
Net Charge 0
Average Mass 197.19136
Monoisotopic Mass 197.080
InChI InChI=1S/C8H11N3O3/c1-5(12)11-7(8(13)14)2-6-3-9-4-10-6/h3-4,7H,2H2,1H3,(H,9,10)(H,11,12)(H,13,14)/t7-/m0/s1
InChIKey KBOJOGQFRVVWBH-ZETCQYMHSA-N
SMILES CC(=O)N[C@@H](Cc1cnc[nH]1)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): animal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in animals that include diverse creatures from sponges, insects to mammals.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing N-acetyl-L-histidine (CHEBI:16437) has role animal metabolite (CHEBI:75767)
N-acetyl-L-histidine (CHEBI:16437) is a N-acetyl-L-amino acid (CHEBI:21545)
N-acetyl-L-histidine (CHEBI:16437) is a L-histidine derivative (CHEBI:84076)
N-acetyl-L-histidine (CHEBI:16437) is conjugate acid of N-acetyl-L-histidinate (CHEBI:57772)
Incoming N-acetyl-L-histidinate (CHEBI:57772) is conjugate base of N-acetyl-L-histidine (CHEBI:16437)
IUPAC Name
N2-acetyl-L-histidine
Synonyms Sources
N-acetyl histidine ChEBI
N-Acetyl-L-histidine KEGG COMPOUND
N-Acetylhistidine ChemIDplus
N-α-L-histidine ChEBI
N-Hydroxy-aabp ChemIDplus
Database Links Databases
C02997 KEGG COMPOUND
CPD-424 MetaCyc
HMDB0032055 HMDB
View more database links
Registry Numbers Types Sources
2497-02-1 CAS Registry Number KEGG COMPOUND
2497-02-1 CAS Registry Number ChemIDplus
748618 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
26800898 PubMed citation Europe PMC
5949241 PubMed citation Europe PMC
7357028 PubMed citation Europe PMC
9084403 PubMed citation Europe PMC
9770642 PubMed citation Europe PMC
Last Modified
04 April 2016