EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H18O6 |
| Net Charge | 0 |
| Average Mass | 354.358 |
| Monoisotopic Mass | 354.11034 |
| SMILES | COc1cc(/C=C(C=O)/C(C=O)=C/c2ccc(O)c(OC)c2)ccc1O |
| InChI | InChI=1S/C20H18O6/c1-25-19-9-13(3-5-17(19)23)7-15(11-21)16(12-22)8-14-4-6-18(24)20(10-14)26-2/h3-12,23-24H,1-2H3/b15-7+,16-8+ |
| InChIKey | RGZIGIOCSACKAU-BGPOSVGRSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| lignin cw compound-3032 (CHEBI:86846) is a phenylpropanoid (CHEBI:26004) |