EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H26N2O6S |
| Net Charge | 0 |
| Average Mass | 470.547 |
| Monoisotopic Mass | 470.15116 |
| SMILES | CCOc1ccc(C=C2C(=O)N(c3ccc(OC)cc3)C(=S)N2CC(=O)OC)cc1OCC |
| InChI | InChI=1S/C24H26N2O6S/c1-5-31-20-12-7-16(14-21(20)32-6-2)13-19-23(28)26(17-8-10-18(29-3)11-9-17)24(33)25(19)15-22(27)30-4/h7-14H,5-6,15H2,1-4H3 |
| InChIKey | ICOWMNWFNQFYMK-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[5-[(3,4-diethoxyphenyl)methylidene]-3-(4-methoxyphenyl)-4-oxo-2-sulfanylidene-1-imidazolidinyl]acetic acid methyl ester (CHEBI:121429) is a α-amino acid ester (CHEBI:46874) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32872 | LINCS |