EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H24N4O7 |
| Net Charge | 0 |
| Average Mass | 396.400 |
| Monoisotopic Mass | 396.16450 |
| SMILES | NC(=O)CC[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O |
| InChI | InChI=1S/C17H24N4O7/c18-11(5-6-14(19)24)15(25)21-13(8-22)16(26)20-12(17(27)28)7-9-1-3-10(23)4-2-9/h1-4,11-13,22-23H,5-8,18H2,(H2,19,24)(H,20,26)(H,21,25)(H,27,28)/t11-,12-,13-/m0/s1 |
| InChIKey | GHAXJVNBAKGWEJ-AVGNSLFASA-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-Ser-Tyr (CHEBI:162490) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]amino]-3-hydroxypropanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid |