EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C17H17ClN2O3S |
| Net Charge | 0 |
| Average Mass | 364.854 |
| Monoisotopic Mass | 364.06484 |
| SMILES | CN(C)CC(O)Cn1c2cc(=O)c(=O)cc-2sc2ccc(Cl)cc21 |
| InChI | InChI=1S/C17H17ClN2O3S/c1-19(2)8-11(21)9-20-12-5-10(18)3-4-16(12)24-17-7-15(23)14(22)6-13(17)20/h3-7,11,21H,8-9H2,1-2H3 |
| InChIKey | REEBVIZJIHXSIU-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Biological Role: | human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 8-chloro-10-[3-(dimethylamino)-2-hydroxypropyl]phenothiazine-2,3-dione (CHEBI:125431) is a benzothiazine (CHEBI:46899) |
| Manual Xrefs | Databases |
|---|---|
| LSM-36922 | LINCS |