EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:93807 - 2-[4-[oxo(thiophen-2-yl)methyl]phenyl]propanoic acid methyl ester
| Formula | C15H14O3S |
| Net Charge | 0 |
| Average Mass | 274.341 |
| Monoisotopic Mass | 274.06637 |
| SMILES | COC(=O)C(C)c1ccc(C(=O)c2cccs2)cc1 |
| InChI | InChI=1S/C15H14O3S/c1-10(15(17)18-2)11-5-7-12(8-6-11)14(16)13-4-3-9-19-13/h3-10H,1-2H3 |
| InChIKey | XJKZZVPYOOIMPE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[4-[oxo(thiophen-2-yl)methyl]phenyl]propanoic acid methyl ester (CHEBI:93807) is a aromatic ketone (CHEBI:76224) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4332 | LINCS |