EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H19N3O4 |
| Net Charge | 0 |
| Average Mass | 269.301 |
| Monoisotopic Mass | 269.13756 |
| SMILES | O=C(O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1 |
| InChI | InChI=1S/C12H19N3O4/c16-10(17)7-14-11(18)9-4-2-6-15(9)12(19)8-3-1-5-13-8/h8-9,13H,1-7H2,(H,14,18)(H,16,17)/t8-,9-/m0/s1 |
| InChIKey | LEIKGVHQTKHOLM-IUCAKERBSA-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-Pro-Gly (CHEBI:162592) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| 2-[[(2S)-1-[(2S)-pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]acetic acid |
| Manual Xrefs | Databases |
|---|---|
| 134149 | ChemSpider |
| Registry Numbers | Sources |
|---|---|
| CAS:16875-10-8 | ChemIDplus |