EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C12H16N2O3S |
| Net Charge | 0 |
| Average Mass | 268.338 |
| Monoisotopic Mass | 268.08816 |
| SMILES | NC(CS)C(=O)NC(Cc1ccccc1)C(=O)O |
| InChI | InChI=1S/C12H16N2O3S/c13-9(7-18)11(15)14-10(12(16)17)6-8-4-2-1-3-5-8/h1-5,9-10,18H,6-7,13H2,(H,14,15)(H,16,17) |
| InChIKey | XZFYRXDAULDNFX-UHFFFAOYSA-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) |
| Cysteinyl-Phenylalanine (CHEBI:173900) is a dipeptide (CHEBI:46761) |
| IUPAC Name |
|---|
| 2-[(2-amino-3-sulanylpropanoyl)amino]-3-phenylpropanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 16568287 | ChemSpider |
| HMDB0028782 | HMDB |