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CHEBI:184939 - 4-{[2,2'-bithiophene]-5-yl}-1-chlorobut-3-yn-2-ol
| Formula | C12H9ClOS2 |
| Net Charge | 0 |
| Average Mass | 268.790 |
| Monoisotopic Mass | 267.97833 |
| SMILES | OC(C#Cc1ccc(-c2cccs2)s1)CCl |
| InChI | InChI=1S/C12H9ClOS2/c13-8-9(14)3-4-10-5-6-12(16-10)11-2-1-7-15-11/h1-2,5-7,9,14H,8H2 |
| InChIKey | GFYWABYZRGXGNU-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Bos taurus (ncbitaxon:9913) | spermatozoon (BTO:0001277) | MetaboLights (MTBLS1071) | Strain: Holstein [LBO:0000132] |
| Mus musculus (ncbitaxon:10090) | feces (BTO:0000440) | MetaboLights (MTBLS3750) | Strain: C57BL/6 Mouse [NCIT:C14424] |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-{[2,2'-bithiophene]-5-yl}-1-chlorobut-3-yn-2-ol (CHEBI:184939) is a ring assembly (CHEBI:36820) |
| 4-{[2,2'-bithiophene]-5-yl}-1-chlorobut-3-yn-2-ol (CHEBI:184939) is a thiophenes (CHEBI:26961) |
| IUPAC Name |
|---|
| 1-chloro-4-(5-thiophen-2-ylthiophen-2-yl)but-3-yn-2-ol |
| Manual Xrefs | Databases |
|---|---|
| 35013572 | ChemSpider |
| HMDB0033269 | HMDB |