EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C11H11O4 |
| Net Charge | -1 |
| Average Mass | 207.205 |
| Monoisotopic Mass | 207.06628 |
| SMILES | COC(=O)C(CC(=O)[O-])c1ccccc1 |
| InChI | InChI=1S/C11H12O4/c1-15-11(14)9(7-10(12)13)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3,(H,12,13)/p-1 |
| InChIKey | KFUIOHIUIZFOOW-UHFFFAOYSA-M |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-methoxy-4-oxo-3-phenylbutanoate (CHEBI:71190) is a monocarboxylic acid anion (CHEBI:35757) |
| 4-methoxy-4-oxo-3-phenylbutanoate (CHEBI:71190) is conjugate base of 4-methoxy-4-oxo-3-phenylbutanoic acid (CHEBI:71214) |
| Incoming Relation(s) |
| 4-methoxy-4-oxo-3-phenylbutanoic acid (CHEBI:71214) is conjugate acid of 4-methoxy-4-oxo-3-phenylbutanoate (CHEBI:71190) |
| IUPAC Name |
|---|
| 4-methoxy-4-oxo-3-phenylbutanoate |
| Synonyms | Source |
|---|---|
| 4-methoxy-4-oxo-3-phenylbutyrate | ChEBI |
| 3-methoxycarbonyl-3-phenylbutanoate | ChEBI |
| 3-methoxycarbonyl-3-phenylbutyrate | ChEBI |
| UniProt Name | Source |
|---|---|
| 4-methoxy-4-oxo-3-phenylbutanoate | UniProt |