EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C18H27N3O5S |
| Net Charge | 0 |
| Average Mass | 397.497 |
| Monoisotopic Mass | 397.16714 |
| SMILES | CC(C)C[C@H](NC(=O)[C@@H](N)CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O |
| InChI | InChI=1S/C18H27N3O5S/c1-10(2)7-14(20-16(23)13(19)9-27)17(24)21-15(18(25)26)8-11-3-5-12(22)6-4-11/h3-6,10,13-15,22,27H,7-9,19H2,1-2H3,(H,20,23)(H,21,24)(H,25,26)/t13-,14-,15-/m0/s1 |
| InChIKey | JXVFJOMFOLFPMP-KKUMJFAQSA-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) |
| Cys-Leu-Tyr (CHEBI:161497) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-4-methylpentanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid |