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CHEBI:88356 - 3-methylphenylacetic acid
| Formula | C9H10O2 |
| Net Charge | 0 |
| Average Mass | 150.177 |
| Monoisotopic Mass | 150.06808 |
| SMILES | Cc1cccc(CC(=O)O)c1 |
| InChI | InChI=1S/C9H10O2/c1-7-3-2-4-8(5-7)6-9(10)11/h2-5H,6H2,1H3,(H,10,11) |
| InChIKey | GJMPSRSMBJLKKB-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus sydowii (ncbitaxon:75750) | - | PubMed (24057165) | Strain: CBMAI 934 |
| Mus musculus (ncbitaxon:10090) | - | MetaboLights (MTBLS225) |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| Biological Role: | fungal xenobiotic metabolite Any fungal metabolite produced by metabolism of a xenobiotic compound in fungi. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-methylphenylacetic acid (CHEBI:88356) has functional parent acetic acid (CHEBI:15366) |
| 3-methylphenylacetic acid (CHEBI:88356) has role fungal xenobiotic metabolite (CHEBI:76968) |
| 3-methylphenylacetic acid (CHEBI:88356) is a benzenes (CHEBI:22712) |
| 3-methylphenylacetic acid (CHEBI:88356) is a monocarboxylic acid (CHEBI:25384) |
| IUPAC Name |
|---|
| (3-methylphenyl)acetic acid |
| Synonyms | Source |
|---|---|
| 3-Tolylacetic acid | HMDB |
| m-Methylphenylacetic acid | HMDB |
| m-Tolylacetic acid | HMDB |
| Manual Xrefs | Databases |
|---|---|
| HMDB0002222 | HMDB |
| Citations |
|---|