| SpectraBase Spectrum ID |
A7u5i5QnjOJ |
| Name |
Alanine |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
302-72-7 |
| ChEBI ID |
16449 |
| Comments |
100 mM Alanine - Aldrich 13,522-4; 100 % D2O 50 mM sodium phosphate 500 uM sodium azide 500 uM DSS - pH 7.4, temperature 298 K |
| Copyright |
Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Data Source |
Madison Metabolomics Consortium - Qiu Cui, Ian Lewis, Mark E. Anderson, John L. Markley. |
| Formula |
C3 H7 N O2 |
| IUPAC Name |
2-aminopropanoic acid |
| InChI |
InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6) |
| InChIKey |
QNAYBMKLOCPYGJ-UHFFFAOYSA-N |
| KEGG Compound ID |
C01401 |
| KEGG Pathways |
PATH: map00460 Cyanoamino acid metabolism |
| PubChem Compound ID |
602 |
| SMILES |
CC(C(=O)O)N |
| Source File Reference |
bmse000282 |
