| SpectraBase Spectrum ID |
9xEhBIhy5Of |
| Name |
DL-alpha,epsilon-Diaminopimelic acid |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
17121-19-6; 14289-34-0; 922-54-3 |
| ChEBI ID |
23673 |
| Comments |
100 mM DL-alpha,epsilon-Diaminopimelic acid - Sigma-Aldrich
Solvent D2O Buffer sodium phosphate Cytocide sodium azide Reference 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 |
| Formula |
C7 H14 N2 O4 |
| IUPAC Name |
2,6-diaminopimelic acid; 2,6-diaminoheptanedioic acid |
| InChI |
InChI=1S/C7H14N2O4/c8-4(6(10)11)2-1-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13) |
| InChIKey |
GMKMEZVLHJARHF-UHFFFAOYSA-N |
| PubChem Compound ID |
865 |
| SMILES |
C(CC(C(=O)O)N)CC(C(=O)O)N |
| Source File Reference |
bmse000401 |
