EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C19H27N3O7S |
| Net Charge | 0 |
| Average Mass | 441.506 |
| Monoisotopic Mass | 441.15697 |
| SMILES | CSCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCC(=O)O)C(=O)O |
| InChI | InChI=1S/C19H27N3O7S/c1-30-9-8-14(19(28)29)21-18(27)15(10-11-2-4-12(23)5-3-11)22-17(26)13(20)6-7-16(24)25/h2-5,13-15,23H,6-10,20H2,1H3,(H,21,27)(H,22,26)(H,24,25)(H,28,29)/t13-,14-,15-/m0/s1 |
| InChIKey | QEJKKJNDDDPSMU-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) |
| Glu-Tyr-Met (CHEBI:163355) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (4S)-4-amino-5-[[(2S)-1-[[(1S)-1-carboxy-3-methylsulanylpropyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid |