EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C14H10N2O5S |
| Net Charge | 0 |
| Average Mass | 318.310 |
| Monoisotopic Mass | 318.03104 |
| SMILES | O=C(CSc1ncccc1C(=O)O)c1cccc([N+](=O)[O-])c1 |
| InChI | InChI=1S/C14H10N2O5S/c17-12(9-3-1-4-10(7-9)16(20)21)8-22-13-11(14(18)19)5-2-6-15-13/h1-7H,8H2,(H,18,19) |
| InChIKey | NLLVFBUITXSIQT-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[[2-(3-nitrophenyl)-2-oxoethyl]thio]-3-pyridinecarboxylic acid (CHEBI:93980) is a aromatic ketone (CHEBI:76224) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4565 | LINCS |