EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C15H19N3O7 |
| Net Charge | 0 |
| Average Mass | 353.331 |
| Monoisotopic Mass | 353.12230 |
| SMILES | N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)O |
| InChI | InChI=1S/C15H19N3O7/c16-10(5-8-1-3-9(19)4-2-8)14(24)18-11(6-12(20)21)15(25)17-7-13(22)23/h1-4,10-11,19H,5-7,16H2,(H,17,25)(H,18,24)(H,20,21)(H,22,23)/t10-,11-/m0/s1 |
| InChIKey | JWHOIHCOHMZSAR-QWRGUYRKSA-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-Gly (CHEBI:164999) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (3S)-3-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4-(carboxymethylamino)-4-oxobutanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 8126029 | ChemSpider |