EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C22H31N7O4 |
| Net Charge | 0 |
| Average Mass | 457.535 |
| Monoisotopic Mass | 457.24375 |
| SMILES | NC(N)=NCCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O |
| InChI | InChI=1S/C22H31N7O4/c23-22(24)26-10-4-8-17(28-19(30)16-7-3-9-25-16)20(31)29-18(21(32)33)11-13-12-27-15-6-2-1-5-14(13)15/h1-2,5-6,12,16-18,25,27H,3-4,7-11H2,(H,28,30)(H,29,31)(H,32,33)(H4,23,24,26)/t16-,17-,18-/m0/s1 |
| InChIKey | NUZHSNLQJDYSRW-BZSNNMDCSA-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-Arg-Trp (CHEBI:162091) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-5-(diaminomethylideneamino)-2-[[(2S)-pyrrolidine-2-carbonyl]amino]pentanoyl]amino]-3-(1H-indol-3-yl)propanoic acid |