EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C25H28N4O4 |
| Net Charge | 0 |
| Average Mass | 448.523 |
| Monoisotopic Mass | 448.21106 |
| SMILES | O=C(O)[C@H](Cc1cnc2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1 |
| InChI | InChI=1S/C25H28N4O4/c30-23(20-11-6-12-26-20)28-21(13-16-7-2-1-3-8-16)24(31)29-22(25(32)33)14-17-15-27-19-10-5-4-9-18(17)19/h1-5,7-10,15,20-22,26-27H,6,11-14H2,(H,28,30)(H,29,31)(H,32,33)/t20-,21-,22-/m0/s1 |
| InChIKey | YYARMJSFDLIDFS-FKBYEOEOSA-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-Phe-Trp (CHEBI:162572) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-3-(1H-indol-3-yl)-2-[[(2S)-3-phenyl-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoyl]amino]propanoic acid |