EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C22H26N4O6 |
| Net Charge | 0 |
| Average Mass | 442.472 |
| Monoisotopic Mass | 442.18523 |
| SMILES | NC(=O)C[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O |
| InChI | InChI=1S/C22H26N4O6/c23-16(10-14-6-8-15(27)9-7-14)20(29)25-17(12-19(24)28)21(30)26-18(22(31)32)11-13-4-2-1-3-5-13/h1-9,16-18,27H,10-12,23H2,(H2,24,28)(H,25,29)(H,26,30)(H,31,32)/t16-,17-,18-/m0/s1 |
| InChIKey | XMNDQSYABVWZRK-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) |
| Tyr-Asn-Phe (CHEBI:164985) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-4-amino-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4-oxobutanoyl]amino]-3-phenylpropanoic acid |