EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C16H21N3O7 |
| Net Charge | 0 |
| Average Mass | 367.358 |
| Monoisotopic Mass | 367.13795 |
| SMILES | C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O |
| InChI | InChI=1S/C16H21N3O7/c1-8(16(25)26)18-15(24)12(7-13(21)22)19-14(23)11(17)6-9-2-4-10(20)5-3-9/h2-5,8,11-12,20H,6-7,17H2,1H3,(H,18,24)(H,19,23)(H,21,22)(H,25,26)/t8-,11-,12-/m0/s1 |
| InChIKey | GAYLGYUVTDMLKC-UWJYBYFXSA-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) |
| Tyr-Asp-Ala (CHEBI:164992) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (3S)-3-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4-[[(1S)-1-carboxyethyl]amino]-4-oxobutanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 7975104 | ChemSpider |