EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C11H17N3O6 |
| Net Charge | 0 |
| Average Mass | 287.272 |
| Monoisotopic Mass | 287.11174 |
| SMILES | O=C(O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1 |
| InChI | InChI=1S/C11H17N3O6/c15-8(16)4-7(10(19)13-5-9(17)18)14-11(20)6-2-1-3-12-6/h6-7,12H,1-5H2,(H,13,19)(H,14,20)(H,15,16)(H,17,18)/t6-,7-/m0/s1 |
| InChIKey | SGCZFWSQERRKBD-BQBZGAKWSA-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) |
| Pro-Asp-Gly (CHEBI:162152) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (3S)-4-(carboxymethylamino)-4-oxo-3-[[(2S)-pyrrolidine-2-carbonyl]amino]butanoic acid |