EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H24N4O5 |
| Net Charge | 0 |
| Average Mass | 316.358 |
| Monoisotopic Mass | 316.17467 |
| SMILES | CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](N)CCC(N)=O)C(=O)O |
| InChI | InChI=1S/C13H24N4O5/c1-3-7(2)11(13(21)22)17-10(19)6-16-12(20)8(14)4-5-9(15)18/h7-8,11H,3-6,14H2,1-2H3,(H2,15,18)(H,16,20)(H,17,19)(H,21,22)/t7-,8-,11-/m0/s1 |
| InChIKey | GNMQDOGFWYWPNM-LAEOZQHASA-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) |
| Gln-Gly-Ile (CHEBI:162156) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S,3S)-2-[[2-[[(2S)-2,5-diamino-5-oxopentanoyl]amino]acetyl]amino]-3-methylpentanoic acid |