EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H34N4O5 |
| Net Charge | 0 |
| Average Mass | 422.526 |
| Monoisotopic Mass | 422.25292 |
| SMILES | CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O |
| InChI | InChI=1S/C21H34N4O5/c1-3-13(2)18(21(29)30)25-20(28)17(6-4-5-11-22)24-19(27)16(23)12-14-7-9-15(26)10-8-14/h7-10,13,16-18,26H,3-6,11-12,22-23H2,1-2H3,(H,24,27)(H,25,28)(H,29,30)/t13-,16-,17-,18-/m0/s1 |
| InChIKey | GYKDRHDMGQUZPU-MGHWNKPDSA-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) |
| Tyr-Lys-Ile (CHEBI:165160) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S,3S)-2-[[(2S)-6-amino-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]hexanoyl]amino]-3-methylpentanoic acid |