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CHEBI:193412 - 1-Cyclohexene-1-acrylic acid, 2,6,6-trimethyl-3-oxo-
| Formula | C12H16O3 |
| Net Charge | 0 |
| Average Mass | 208.257 |
| Monoisotopic Mass | 208.10994 |
| SMILES | CC1=C(C=CC(=O)O)C(C)(C)CCC1=O |
| InChI | InChI=1S/C12H16O3/c1-8-9(4-5-11(14)15)12(2,3)7-6-10(8)13/h4-5H,6-7H2,1-3H3,(H,14,15) |
| InChIKey | ZYMHWNZSGHDLBN-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | feces (BTO:0000440) | MetaboLights (MTBLS5335) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-Cyclohexene-1-acrylic acid, 2,6,6-trimethyl-3-oxo- (CHEBI:193412) is a cyclohexenones (CHEBI:48953) |
| IUPAC Name |
|---|
| 3-(2,6,6-trimethyl-3-oxocyclohexen-1-yl)prop-2-enoic acid |
| Manual Xrefs | Databases |
|---|---|
| 62114058 | ChemSpider |