EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C22H26N6O4 |
| Net Charge | 0 |
| Average Mass | 438.488 |
| Monoisotopic Mass | 438.20155 |
| SMILES | N[C@@H](Cc1cncn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O |
| InChI | InChI=1S/C22H26N6O4/c23-16(9-14-11-24-12-26-14)21(30)28-7-3-6-19(28)20(29)27-18(22(31)32)8-13-10-25-17-5-2-1-4-15(13)17/h1-2,4-5,10-12,16,18-19,25H,3,6-9,23H2,(H,24,26)(H,27,29)(H,31,32)/t16-,18-,19-/m0/s1 |
| InChIKey | AVQNTYBAFBKMDL-WDSOQIARSA-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) |
| His-Pro-Trp (CHEBI:157919) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-1-[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carbonyl]amino]-3-(1H-indol-3-yl)propanoic acid |