EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H18O5 |
| Net Charge | 0 |
| Average Mass | 290.315 |
| Monoisotopic Mass | 290.11542 |
| SMILES | COc1cc(OC)c2c(O)c3c(cc2c1)[C@H](O)[C@@H](C)OC3 |
| InChI | InChI=1S/C16H18O5/c1-8-15(17)11-5-9-4-10(19-2)6-13(20-3)14(9)16(18)12(11)7-21-8/h4-6,8,15,17-18H,7H2,1-3H3/t8-,15-/m1/s1 |
| InChIKey | KXVHFZAGCYTXEZ-ANRSDYALSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Conoideocrella (ncbitaxon:1105318) | - | DOI (10.1016/j.tet.2015.02.082) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (3R,4S)-7,9-dimethoxy-3-methyl-3,4-dihydro-1H-benzo[g]isochromene-4,10-diol (CHEBI:210237) is a organic heterotricyclic compound (CHEBI:26979) |
| (3R,4S)-7,9-dimethoxy-3-methyl-3,4-dihydro-1H-benzo[g]isochromene-4,10-diol (CHEBI:210237) is a organooxygen compound (CHEBI:36963) |
| IUPAC Name |
|---|
| (3R,4S)-7,9-dimethoxy-3-methyl-3,4-dihydro-1H-benzo[g]isochromene-4,10-diol |
| Manual Xrefs | Databases |
|---|---|
| 78438489 | ChemSpider |