EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C20H31N3O4S |
| Net Charge | 0 |
| Average Mass | 409.552 |
| Monoisotopic Mass | 409.20353 |
| SMILES | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O |
| InChI | InChI=1S/C20H31N3O4S/c1-13(2)11-17(19(25)22-16(20(26)27)9-10-28-3)23-18(24)15(21)12-14-7-5-4-6-8-14/h4-8,13,15-17H,9-12,21H2,1-3H3,(H,22,25)(H,23,24)(H,26,27)/t15-,16-,17-/m0/s1 |
| InChIKey | KPEIBEPEUAZWNS-ULQDDVLXSA-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) |
| Phe-Leu-Met (CHEBI:161656) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-4-methylsulanylbutanoic acid |