EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H26N4O6 |
| Net Charge | 0 |
| Average Mass | 358.395 |
| Monoisotopic Mass | 358.18523 |
| SMILES | NCCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)O |
| InChI | InChI=1S/C15H26N4O6/c16-6-2-1-4-10(15(24)25)18-14(23)11(8-12(20)21)19-13(22)9-5-3-7-17-9/h9-11,17H,1-8,16H2,(H,18,23)(H,19,22)(H,20,21)(H,24,25)/t9-,10-,11-/m0/s1 |
| InChIKey | XKHCJJPNXFBADI-DCAQKATOSA-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-Lys (CHEBI:162159) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-6-amino-2-[[(2S)-3-carboxy-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoyl]amino]hexanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 16573859 | ChemSpider |