EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C11H17N3O8 |
| Net Charge | 0 |
| Average Mass | 319.270 |
| Monoisotopic Mass | 319.10156 |
| SMILES | N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)O |
| InChI | InChI=1S/C11H17N3O8/c12-5(3-8(17)18)10(21)14-6(1-2-7(15)16)11(22)13-4-9(19)20/h5-6H,1-4,12H2,(H,13,22)(H,14,21)(H,15,16)(H,17,18)(H,19,20)/t5-,6-/m0/s1 |
| InChIKey | VFUXXFVCYZPOQG-WDSKDSINSA-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) |
| Asp-Glu-Gly (CHEBI:160527) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (4S)-4-[[(2S)-2-amino-3-carboxypropanoyl]amino]-5-(carboxymethylamino)-5-oxopentanoic acid |