| SpectraBase Spectrum ID |
2ps9eLHfPAJ |
| Name |
D-Aspartate |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
1783-96-6 |
| ChEBI ID |
17364 |
| Comments |
100 mM D-Aspartate - Sigma A8881; 100 % D2O 50 mM sodium phosphate 500 uM sodium azide 500 uM DSS - pH 7.4, temperature 298 K |
| Copyright |
Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Data Source |
Madison Metabolomics Consortium - Qiu Cui, Ian Lewis, Mark E. Anderson, John L. Markley. |
| Formula |
C4 H7 N O4 |
| IUPAC Name |
(2S)-2-aminobutanedioic acid; (2S)-2-aminosuccinic acid |
| InChI |
InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/t2-/m1/s1 |
| InChIKey |
CKLJMWTZIZZHCS-UWTATZPHSA-N |
| KEGG Compound ID |
C00402 |
| KEGG Pathways |
PATH: map00252 Alanine and aspartate metabolism
PATH: map02010 ABC transporters û General |
| PubChem Compound ID |
83887 |
| SMILES |
C(C(C(=O)O)N)C(=O)O |
| Source File Reference |
bmse000273 |
