EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H13NO3S |
| Net Charge | 0 |
| Average Mass | 287.340 |
| Monoisotopic Mass | 287.06161 |
| SMILES | O=c1oc(-c2ccco2)nc2sc3c(c12)CCCCC3 |
| InChI | InChI=1S/C15H13NO3S/c17-15-12-9-5-2-1-3-7-11(9)20-14(12)16-13(19-15)10-6-4-8-18-10/h4,6,8H,1-3,5,7H2 |
| InChIKey | CYSBQOZDMJMKOX-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-(2-furanyl)-6,7,8,9-tetrahydro-5H-cyclohepta[2,3]thieno[2,4-b][1,3]oxazin-4-one (CHEBI:114459) is a heteroarene (CHEBI:33833) |
| Manual Xrefs | Databases |
|---|---|
| LSM-25920 | LINCS |