EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H28N4O4S |
| Net Charge | 0 |
| Average Mass | 432.546 |
| Monoisotopic Mass | 432.18313 |
| SMILES | CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1cnc2ccccc12)C(=O)O |
| InChI | InChI=1S/C21H28N4O4S/c1-30-10-8-17(21(28)29)24-19(26)18-7-4-9-25(18)20(27)15(22)11-13-12-23-16-6-3-2-5-14(13)16/h2-3,5-6,12,15,17-18,23H,4,7-11,22H2,1H3,(H,24,26)(H,28,29)/t15-,17-,18-/m0/s1 |
| InChIKey | XOSGQKFEIOCPIJ-SZMVWBNQSA-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-Pro-Met (CHEBI:164825) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-1-[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]pyrrolidine-2-carbonyl]amino]-4-methylsulanylbutanoic acid |