EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H19ClO5 |
| Net Charge | 0 |
| Average Mass | 350.798 |
| Monoisotopic Mass | 350.09210 |
| SMILES | C[C@H]1C/C=C/CC/C=C/C(=O)Cc2c(Cl)c(O)cc(O)c2C(=O)O1 |
| InChI | InChI=1S/C18H19ClO5/c1-11-7-5-3-2-4-6-8-12(20)9-13-16(18(23)24-11)14(21)10-15(22)17(13)19/h3,5-6,8,10-11,21-22H,2,4,7,9H2,1H3/b5-3+,8-6+/t11-/m0/s1 |
| InChIKey | FJVQHTGEXYKKBS-QGSHSPQNSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Humicola (ncbitaxon:5526) | - | PubMed (12931861) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Monorden D (CHEBI:219183) is a macrolide (CHEBI:25106) |
| IUPAC Name |
|---|
| (6E,10E)-15-chloro-16,18-dihydroxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaene-2,12-dione |
| Manual Xrefs | Databases |
|---|---|
| 9101420 | ChemSpider |