EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:218475 - 3-hydroxy-2-(2-hydroxy-6-methoxy-4-methylbenzoyl)-5-methoxy-benzoic acid methyl ester
| Formula | C18H18O7 |
| Net Charge | 0 |
| Average Mass | 346.335 |
| Monoisotopic Mass | 346.10525 |
| SMILES | COC(=O)c1cc(OC)cc(O)c1C(=O)c1c(O)cc(C)cc1OC |
| InChI | InChI=1S/C18H18O7/c1-9-5-12(19)16(14(6-9)24-3)17(21)15-11(18(22)25-4)7-10(23-2)8-13(15)20/h5-8,19-20H,1-4H3 |
| InChIKey | XJWDUCZIIDUZSH-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus (ncbitaxon:5052) | - | DOI (10.1177/1934578X1801300514) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-hydroxy-2-(2-hydroxy-6-methoxy-4-methylbenzoyl)-5-methoxy-benzoic acid methyl ester (CHEBI:218475) is a benzophenones (CHEBI:22726) |
| IUPAC Name |
|---|
| methyl 3-hydroxy-2-(2-hydroxy-6-methoxy-4-methylbenzoyl)-5-methoxybenzoate |
| Manual Xrefs | Databases |
|---|---|
| 70951804 | ChemSpider |