EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H16Cl2O5 |
| Net Charge | 0 |
| Average Mass | 383.227 |
| Monoisotopic Mass | 382.03748 |
| SMILES | COc1c(C)c2c(c(C)c1Cl)Oc1c(C)c(O)c(Cl)c(C)c1C(=O)O2 |
| InChI | InChI=1S/C18H16Cl2O5/c1-6-10-14(8(3)13(21)11(6)19)24-16-7(2)12(20)15(23-5)9(4)17(16)25-18(10)22/h21H,1-5H3 |
| InChIKey | DJIUVCGPONSSSV-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Teloschistes flavicans (ncbitaxon:442469) | - | DOI (10.1016/s0040-4020(01)92711-5) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Vicanicin (CHEBI:198427) is a carbonyl compound (CHEBI:36586) |
| IUPAC Name |
|---|
| 2,8-dichloro-9-hydroxy-3-methoxy-1,4,7,10-tetramethylbenzo[b][1,4]benzodioxepin-6-one |
| Manual Xrefs | Databases |
|---|---|
| 287195 | ChemSpider |