EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C8H16N2O3 |
| Net Charge | 0 |
| Average Mass | 188.227 |
| Monoisotopic Mass | 188.11609 |
| SMILES | CC(N)C(=O)NC(C(=O)O)C(C)C |
| InChI | InChI=1S/C8H16N2O3/c1-4(2)6(8(12)13)10-7(11)5(3)9/h4-6H,9H2,1-3H3,(H,10,11)(H,12,13) |
| InChIKey | LIWMQSWFLXEGMA-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| DL-Alanyl-DL-valine (CHEBI:182838) is a dipeptide (CHEBI:46761) |
| IUPAC Name |
|---|
| 2-(2-aminopropanoylamino)-3-methylbutanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 120970 | ChemSpider |
| HMDB0028700 | HMDB |
| Registry Numbers | Sources |
|---|---|
| CAS:1999-46-8 | ChemIDplus |