EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C11H16N2O4S |
| Net Charge | 0 |
| Average Mass | 272.326 |
| Monoisotopic Mass | 272.08308 |
| SMILES | NCCc1cc(O)c(O)c(SC[C@@H](N)C(=O)O)c1 |
| InChI | InChI=1S/C11H16N2O4S/c12-2-1-6-3-8(14)10(15)9(4-6)18-5-7(13)11(16)17/h3-4,7,14-15H,1-2,5,12-13H2,(H,16,17)/t7-/m1/s1 |
| InChIKey | BZYHBWCVRKSWDB-SSDOTTSWSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (2S)-2-amino-3-[[5-(2-aminoethyl)-2,3-dihydroxyphenyl]thio]propanoic acid (CHEBI:125550) is a L-cysteine derivative (CHEBI:83824) |
| (2S)-2-amino-3-[[5-(2-aminoethyl)-2,3-dihydroxyphenyl]thio]propanoic acid (CHEBI:125550) is a phenols (CHEBI:33853) |
| Manual Xrefs | Databases |
|---|---|
| LSM-37071 | LINCS |