EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H20O5 |
| Net Charge | 0 |
| Average Mass | 280.320 |
| Monoisotopic Mass | 280.13107 |
| SMILES | COc1cccc(/C=C/[C@@H]2O[C@H](C)[C@@H](O)[C@H]2O)c1CO |
| InChI | InChI=1S/C15H20O5/c1-9-14(17)15(18)13(20-9)7-6-10-4-3-5-12(19-2)11(10)8-16/h3-7,9,13-18H,8H2,1-2H3/b7-6+/t9-,13+,14-,15+/m1/s1 |
| InChIKey | JGUADRHIBCXAFH-MVBSPKBLSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus stellatus (ncbitaxon:1549217) | - | PubMed (11908979) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Varitriol (CHEBI:199545) is a C-glycosyl compound (CHEBI:20857) |
| IUPAC Name |
|---|
| (2S,3R,4S,5R)-2-[(E)-2-[2-(hydroxymethyl)-3-methoxyphenyl]ethenyl]-5-methyloxolane-3,4-diol |
| Manual Xrefs | Databases |
|---|---|
| 9725678 | ChemSpider |