EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C10H19N3O5 |
| Net Charge | 0 |
| Average Mass | 261.278 |
| Monoisotopic Mass | 261.13247 |
| SMILES | NCCCCC(N)C(=O)NC(CC(=O)O)C(=O)O |
| InChI | InChI=1S/C10H19N3O5/c11-4-2-1-3-6(12)9(16)13-7(10(17)18)5-8(14)15/h6-7H,1-5,11-12H2,(H,13,16)(H,14,15)(H,17,18) |
| InChIKey | CIOWSLJGLSUOME-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Malus domestica (ncbitaxon:3750) | exocarp (BTO:0000733) | MetaboLights (MTBLS2384) | Strain: Malus x domestica Borkh. cv. Ruixue |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Lysyl-Aspartate (CHEBI:168743) is a dipeptide (CHEBI:46761) |
| IUPAC Name |
|---|
| 2-(2,6-diaminohexanoylamino)butanedioic acid |
| Manual Xrefs | Databases |
|---|---|
| 2543051 | ChemSpider |
| HMDB0028947 | HMDB |