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CHEBI:229912 - mfcd01632327
| Formula | C17H26ClNO3S |
| Net Charge | 0 |
| Average Mass | 359.919 |
| Monoisotopic Mass | 359.13219 |
| SMILES | CCSC(C)CC1CC(=O)C(/C(CC)=N/OC/C=C/Cl)=C(O)C1 |
| InChI | InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+ |
| InChIKey | SILSDTWXNBZOGF-KUZBFYBWSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | feces (BTO:0000440) | MetaboLights (MTBLS9087) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| mfcd01632327 (CHEBI:229912) is a cyclohexenones (CHEBI:48953) |
| IUPAC Name |
|---|
| 2-[(E)-N-[(E)-3-chloroprop-2-enoxy]-C-ethylcarbonimidoyl]-5-(2-ethylsulanylpropyl)-3-hydroxycyclohex-2-en-1-one |