Systematic / IUPAC Name: (2S,6S)-2,6-Diaminoheptanedioic acid
ID: Reference14012
Other Names: AA-4460
Formula: C7H14N2O4
Class: Endogenous Metabolites
L,L-Diaminopimelic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
| Used Instruments | Orbitrap ID-X with ETD_Cal Gateshead |
| No. of Spectral Trees | 2 |
| No. of Spectra | 1535 |
| Tandem Spectra | MS1, MS2, MS3, MS4, MS5 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 7/24/2026 8:28:45 AM |
| 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)/t4-,5-/m0/s1 |
| InChI Key | GMKMEZVLHJARHF-WHFBIAKZSA-N |
| Canonical SMILES | N[C@@H](CCC[C@H](N)C(=O)O)C(=O)O |
| CAS | |
| Splash | |
| Other Names | AA-4460 |
| ChEBI | CHEBI:16026 |
| HMDb | HMDB0001370; HMDB0001370; HMDB0001370 |
| ChemSpider | 388416 |
| PubChem | 1549100 |
| KEGG | C00666 |
| DrugBank | DB03590; DB03590 |
| LipidsMAPs | LMFA01170102 |