EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C8H8O4 |
| Net Charge | 0 |
| Average Mass | 168.148 |
| Monoisotopic Mass | 168.04226 |
| SMILES | Cc1cc(=O)oc(C)c1C(=O)O |
| InChI | InChI=1S/C8H8O4/c1-4-3-6(9)12-5(2)7(4)8(10)11/h3H,1-2H3,(H,10,11) |
| InChIKey | QOADIMYPCZMZSG-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus Musculus (ncbitaxon:10090) | |||
| blood plasma (BTO:0000131) | MetaboLights (MTBLS1903) | Strain: C57BL/6N Mouse [THESAURUS.OWL#C37385] | |
| liver (BTO:0000759) | MetaboLights (MTBLS1903) | Strain: C57BL/6N Mouse [THESAURUS.OWL#C37385] |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Isodehydracetic acid (CHEBI:169987) is a pyranone (CHEBI:37963) |
| IUPAC Name |
|---|
| 2,4-dimethyl-6-oxopyran-3-carboxylic acid |