EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C19H21NO5S |
| Net Charge | 0 |
| Average Mass | 375.446 |
| Monoisotopic Mass | 375.11404 |
| SMILES | COc1ccc(C2CC(=C3C(=O)C=C(C)OC3=O)NCCS2)c(OC)c1 |
| InChI | InChI=1S/C19H21NO5S/c1-11-8-15(21)18(19(22)25-11)14-10-17(26-7-6-20-14)13-5-4-12(23-2)9-16(13)24-3/h4-5,8-9,17,20H,6-7,10H2,1-3H3 |
| InChIKey | FJDFKOSFDPIMBV-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-[7-(2,4-dimethoxyphenyl)-1,4-thiazepan-5-ylidene]-6-methylpyran-2,4-dione (CHEBI:91760) is a dimethoxybenzene (CHEBI:51681) |
| Manual Xrefs | Databases |
|---|---|
| LSM-1641 | LINCS |