EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C12H16O3 |
| Net Charge | 0 |
| Average Mass | 208.257 |
| Monoisotopic Mass | 208.10994 |
| SMILES | CC(C)(C)c1ccc(OCC(=O)O)cc1 |
| InChI | InChI=1S/C12H16O3/c1-12(2,3)9-4-6-10(7-5-9)15-8-11(13)14/h4-7H,8H2,1-3H3,(H,13,14) |
| InChIKey | FBIGAJNVRFKBJL-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | feces (BTO:0000440) | MetaboLights (MTBLS3750) | Strain: C57BL/6 Mouse [NCIT:C14424] |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (4-tert-Butyl-phenoxy)-acetic acid (CHEBI:186680) is a monocarboxylic acid (CHEBI:25384) |
| IUPAC Name |
|---|
| 2-(4-tert-butylphenoxy)acetic acid |