EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H21ClO5 |
| Net Charge | 0 |
| Average Mass | 352.814 |
| Monoisotopic Mass | 352.10775 |
| SMILES | CO/C=C(C(=O)OC)\C(C)=C(/C=C/c1ccc(Cl)c(OC)c1)OC |
| InChI | InChI=1S/C18H21ClO5/c1-12(14(11-21-2)18(20)24-5)16(22-3)9-7-13-6-8-15(19)17(10-13)23-4/h6-11H,1-5H3/b9-7+,14-11+,16-12+ |
| InChIKey | YMXFXCLZQAQAGG-WIMKLWOJSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Favolaschia (ncbitaxon:139071) | - | PubMed (20329738) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 9-methoxystrobilurin B (CHEBI:201370) is a methoxybenzenes (CHEBI:51683) |
| IUPAC Name |
|---|
| methyl (2E,3E,5E)-6-(4-chloro-3-methoxyphenyl)-4-methoxy-2-(methoxymethylidene)-3-methylhexa-3,5-dienoate |
| Manual Xrefs | Databases |
|---|---|
| 24669126 | ChemSpider |