EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C8H13N3O3 |
| Net Charge | 0 |
| Average Mass | 199.210 |
| Monoisotopic Mass | 199.09569 |
| SMILES | N#CCCNC(=O)CC[C@H](N)C(=O)O |
| InChI | InChI=1S/C8H13N3O3/c9-4-1-5-11-7(12)3-2-6(10)8(13)14/h6H,1-3,5,10H2,(H,11,12)(H,13,14)/t6-/m0/s1 |
| InChIKey | VQPVVWAFTIFKDD-LURJTMIESA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | - | PubMed (19425150) | Source: BioModels - MODEL1507180067 |
| Roles Classification |
|---|
| Chemical Roles: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| Biological Role: | mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| γ-glutamyl-β-aminopropiononitrile (CHEBI:28092) has functional parent β-aminopropionitrile (CHEBI:27413) |
| γ-glutamyl-β-aminopropiononitrile (CHEBI:28092) has role mouse metabolite (CHEBI:75771) |
| γ-glutamyl-β-aminopropiononitrile (CHEBI:28092) is a L-glutamine derivative (CHEBI:24317) |
| γ-glutamyl-β-aminopropiononitrile (CHEBI:28092) is a aliphatic nitrile (CHEBI:80291) |
| γ-glutamyl-β-aminopropiononitrile (CHEBI:28092) is a non-proteinogenic L-α-amino acid (CHEBI:83822) |
| γ-glutamyl-β-aminopropiononitrile (CHEBI:28092) is a secondary carboxamide (CHEBI:140325) |
| IUPAC Name |
|---|
| N-(2-cyanoethyl)-L-glutamine |
| Synonyms | Source |
|---|---|
| gamma-Glutamyl-beta-aminopropiononitrile | KEGG COMPOUND |
| gamma-Glutamyl-3-aminopropiononitrile | KEGG COMPOUND |
| Manual Xrefs | Databases |
|---|---|
| C06114 | KEGG COMPOUND |
| Registry Numbers | Sources |
|---|---|
| Reaxys:1727448 | Reaxys |