β-Alanyl-L-histidine

enlarge

Systematic / IUPAC Name: (2S)-2-(3-Aminopropanoylamino)-3-(1H-imidazol-5-yl)propanoic acid

ID: Reference13759

Other Names: Carnosine;
L-Carnosine;
AA-3890

Formula: C9H14N4O3

Class: Endogenous Metabolites

Spectral Data

β-Alanyl-L-histidine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap ID-X with ETD_Cal Gateshead
No. of Spectral Trees 2
No. of Spectra 3903
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 1/26/2026 8:54:37 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C9H14N4O3/c10-2-1-8(14)13-7(9(15)16)3-6-4-11-5-12-6/h4-5,7H,1-3,10H2,(H,11,12)(H,13,14)(H,15,16)/t7-/m0/s1
InChI Key CQOVPNPJLQNMDC-ZETCQYMHSA-N
Canonical SMILES NCCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O
CAS
Splash
Other Names Carnosine;
L-Carnosine;
AA-3890

In Other Databases

ChEBI CHEBI:15727
HMDb HMDB00033
KEGG C00386
ChEMBL CHEMBL242948
DrugBank DB11695
PubChem 6992100; 439224
Wikipedia Carnosine
ChemSpider More details; 388363