Alanylalanylalanine
14015
Reference
Alanylalanylalanine Structure
Systematic / IUPAC Name: 2-[2-(2-Aminopropanoylamino)propanoylamino]propanoic acid
ID: Reference14015
Other Names:
H-Ala-Ala-D-Ala-OH;
AA-5863
Formula: C9H17N3O4
Class: Endogenous Metabolites
Spectral Data
Alanylalanylalanine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap ID-X with ETD_Cal Gateshead |
| No. of Spectral Trees | 2 |
| No. of Spectra | 1079 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 7/24/2026 1:13:57 PM |
Identificators
| InChI | InChI=1S/C9H17N3O4/c1-4(10)7(13)11-5(2)8(14)12-6(3)9(15)16/h4-6H,10H2,1-3H3,(H,11,13)(H,12,14)(H,15,16) |
| InChI Key | BYXHQQCXAJARLQ-UHFFFAOYSA-N |
| Canonical SMILES | CC(N)C(=O)NC(C)C(=O)NC(C)C(=O)O |
| CAS | |
| Splash | |
| Other Names |
H-Ala-Ala-D-Ala-OH; AA-5863 |