EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H16O5 |
| Net Charge | 0 |
| Average Mass | 288.299 |
| Monoisotopic Mass | 288.09977 |
| SMILES | Cc1cc(O)c(Cc2c(C)cc(O)cc2O)c(O)c1C=O |
| InChI | InChI=1S/C16H16O5/c1-8-3-10(18)5-15(20)11(8)6-12-14(19)4-9(2)13(7-17)16(12)21/h3-5,7,18-21H,6H2,1-2H3 |
| InChIKey | DOKDJQJWWVMHLL-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus nidulans (ncbitaxon:162425) | - | PubMed (22510154) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-(2,4-dihydroxy-6-methylbenzyl)-orsellinaldehyde (CHEBI:204319) is a diarylmethane (CHEBI:51614) |
| IUPAC Name |
|---|
| 3-[(2,4-dihydroxy-6-methylphenyl)methyl]-2,4-dihydroxy-6-methylbenzaldehyde |
| Manual Xrefs | Databases |
|---|---|
| 78435555 | ChemSpider |