EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C25H29N5O6 |
| Net Charge | 0 |
| Average Mass | 495.536 |
| Monoisotopic Mass | 495.21178 |
| SMILES | NC(=O)CC[C@H](NC(=O)[C@@H](N)Cc1cnc2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O |
| InChI | InChI=1S/C25H29N5O6/c26-18(12-15-13-28-19-4-2-1-3-17(15)19)23(33)29-20(9-10-22(27)32)24(34)30-21(25(35)36)11-14-5-7-16(31)8-6-14/h1-8,13,18,20-21,28,31H,9-12,26H2,(H2,27,32)(H,29,33)(H,30,34)(H,35,36)/t18-,20-,21-/m0/s1 |
| InChIKey | ZJKZLNAECPIUTL-JBACZVJFSA-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) |
| Trp-Gln-Tyr (CHEBI:164630) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-5-oxopentanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid |