EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C18H21NO3S |
| Net Charge | 0 |
| Average Mass | 331.437 |
| Monoisotopic Mass | 331.12421 |
| SMILES | CCCOC(=O)C1C(C)=NC2=C(C(=O)CCC2)C1c1cccs1 |
| InChI | InChI=1S/C18H21NO3S/c1-3-9-22-18(21)15-11(2)19-12-6-4-7-13(20)16(12)17(15)14-8-5-10-23-14/h5,8,10,15,17H,3-4,6-7,9H2,1-2H3 |
| InChIKey | SRRQGJHZWQUMGX-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-methyl-5-oxo-4-thiophen-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid propyl ester (CHEBI:105286) is a cyclohexenones (CHEBI:48953) |
| Manual Xrefs | Databases |
|---|---|
| LSM-16649 | LINCS |