EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H24O6 |
| Net Charge | 0 |
| Average Mass | 324.373 |
| Monoisotopic Mass | 324.15729 |
| SMILES | COc1cc(O)cc2c1C(=O)O[C@@H](C)C[C@@H](O)[C@H](O)CCCC2 |
| InChI | InChI=1S/C17H24O6/c1-10-7-14(20)13(19)6-4-3-5-11-8-12(18)9-15(22-2)16(11)17(21)23-10/h8-10,13-14,18-20H,3-7H2,1-2H3/t10-,13+,14+/m0/s1 |
| InChIKey | WWEJSODFEKPGPJ-ZLKJLUDKSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Pseudallescheria (ncbitaxon:5596) | - | PubMed (27043524) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (5S, 6S)-dihydroxylasiodiplodin (CHEBI:205941) is a macrolide (CHEBI:25106) |
| IUPAC Name |
|---|
| (4S,6R,7R)-6,7,14-trihydroxy-16-methoxy-4-methyl-3-oxabicyclo[10.4.0]hexadeca-1(12),13,15-trien-2-one |
| Manual Xrefs | Databases |
|---|---|
| 58196772 | ChemSpider |