EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C12H23N3O5S |
| Net Charge | 0 |
| Average Mass | 321.399 |
| Monoisotopic Mass | 321.13584 |
| SMILES | CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O |
| InChI | InChI=1S/C12H23N3O5S/c1-6(14-11(18)9(13)7(2)16)10(17)15-8(12(19)20)4-5-21-3/h6-9,16H,4-5,13H2,1-3H3,(H,14,18)(H,15,17)(H,19,20)/t6-,7+,8-,9-/m0/s1 |
| InChIKey | GFDUZZACIWNMPE-KZVJFYERSA-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) |
| Thr-Ala-Met (CHEBI:163634) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]propanoyl]amino]-4-methylsulanylbutanoic acid |