EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C9H15N3O6 |
| Net Charge | 0 |
| Average Mass | 261.234 |
| Monoisotopic Mass | 261.09609 |
| SMILES | C[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)NCC(=O)O |
| InChI | InChI=1S/C9H15N3O6/c1-4(8(17)11-3-7(15)16)12-9(18)5(10)2-6(13)14/h4-5H,2-3,10H2,1H3,(H,11,17)(H,12,18)(H,13,14)(H,15,16)/t4-,5-/m0/s1 |
| InChIKey | HPNDBHLITCHRSO-WHFBIAKZSA-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-Ala-Gly (CHEBI:160291) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (3S)-3-amino-4-[[(2S)-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-4-oxobutanoic acid |