EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H28O8 |
| Net Charge | 0 |
| Average Mass | 444.480 |
| Monoisotopic Mass | 444.17842 |
| SMILES | Cc1ccc2c(c1O)C(=O)c1c(C)cc(O[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc1C2(C)C |
| InChI | InChI=1S/C24H28O8/c1-10-5-6-13-17(18(10)26)20(28)16-11(2)7-12(8-14(16)24(13,3)4)31-23-22(30)21(29)19(27)15(9-25)32-23/h5-8,15,19,21-23,25-27,29-30H,9H2,1-4H3/t15-,19+,21+,22-,23+/m1/s1 |
| InChIKey | MKUVTEGBXCAVFG-ACYMDBPDSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Actinomadura (ncbitaxon:1988) | - | DOI (10.1016/j.phytol.2018.04.002) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (+)-oxanthromicin E (CHEBI:215060) is a glycoside (CHEBI:24400) |
| IUPAC Name |
|---|
| 1-hydroxy-2,8,10,10-tetramethyl-6-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyanthracen-9-one |