EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C21H24O6 |
| Net Charge | 0 |
| Average Mass | 372.417 |
| Monoisotopic Mass | 372.15729 |
| SMILES | CC(C)(O)[C@@H]1CC[C@@](C)(/C=C/C=C2/C=C(c3cc(O)ccc3O)OC2=O)O1 |
| InChI | InChI=1S/C21H24O6/c1-20(2,25)18-8-10-21(3,27-18)9-4-5-13-11-17(26-19(13)24)15-12-14(22)6-7-16(15)23/h4-7,9,11-12,18,22-23,25H,8,10H2,1-3H3/b9-4+,13-5-/t18-,21+/m0/s1 |
| InChIKey | ZCBZIKUEIKEDHK-DVVMZBMZSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Ganoderma (ncbitaxon:5314) | - | DOI (10.1016/j.tet.2018.06.053) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (-)-ganotheaecolumol E (CHEBI:211452) is a hydroquinones (CHEBI:24646) |
| IUPAC Name |
|---|
| (3Z)-5-(2,5-dihydroxyphenyl)-3-[(E)-3-[(2S,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]prop-2-enylidene]uran-2-one |
| Manual Xrefs | Databases |
|---|---|
| 78441725 | ChemSpider |