EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C17H23N3O7 |
| Net Charge | 0 |
| Average Mass | 381.385 |
| Monoisotopic Mass | 381.15360 |
| SMILES | C[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O |
| InChI | InChI=1S/C17H23N3O7/c1-9(15(24)20-13(17(26)27)6-7-14(22)23)19-16(25)12(18)8-10-2-4-11(21)5-3-10/h2-5,9,12-13,21H,6-8,18H2,1H3,(H,19,25)(H,20,24)(H,22,23)(H,26,27)/t9-,12-,13-/m0/s1 |
| InChIKey | IELISNUVHBKYBX-XDTLVQLUSA-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-Ala-Glu (CHEBI:164938) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]pentanedioic acid |
| Manual Xrefs | Databases |
|---|---|
| 57536757 | ChemSpider |