EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C9H16N2O5 |
| Net Charge | 0 |
| Average Mass | 232.236 |
| Monoisotopic Mass | 232.10592 |
| SMILES | CC(C)[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)O |
| InChI | InChI=1S/C9H16N2O5/c1-4(2)7(9(15)16)11-8(14)5(10)3-6(12)13/h4-5,7H,3,10H2,1-2H3,(H,11,14)(H,12,13)(H,15,16)/t5-,7-/m0/s1 |
| InChIKey | CPMKYMGGYUFOHS-FSPLSTOPSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| Biological Role: | metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Asp-Val (CHEBI:73832) has role metabolite (CHEBI:25212) |
| Asp-Val (CHEBI:73832) is a dipeptide (CHEBI:46761) |
| IUPAC Name |
|---|
| L-α-aspartyl-L-valine |
| Synonyms | Source |
|---|---|
| aspartylvaline | ChEBI |
| L-Asp-L-Val | ChEBI |
| α-aspartylvaline | ChEBI |
| DV | ChEBI |
| L-α-Asp-L-Val | ChEBI |
| Aspartyl-Valine | HMDB |
| Manual Xrefs | Databases |
|---|---|
| HMDB0028766 | HMDB |
| Registry Numbers | Sources |
|---|---|
| Reaxys:1713814 | Reaxys |