EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H14O6 |
| Net Charge | 0 |
| Average Mass | 254.238 |
| Monoisotopic Mass | 254.07904 |
| SMILES | COC(=O)CCOC(=O)c1c(C)cc(O)cc1O |
| InChI | InChI=1S/C12H14O6/c1-7-5-8(13)6-9(14)11(7)12(16)18-4-3-10(15)17-2/h5-6,13-14H,3-4H2,1-2H3 |
| InChIKey | WGKJVBDRDMWUHU-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Penicillium (ncbitaxon:5073) | - | PubMed (29864480) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Penicimenolidyu A (CHEBI:217979) is a 4-hydroxybenzoate ester (CHEBI:79323) |
| IUPAC Name |
|---|
| (3-methoxy-3-oxopropyl) 2,4-dihydroxy-6-methylbenzoate |