EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:93633 - 3-hydroxy-1-methoxy-9,10-dioxo-2-anthracenecarboxaldehyde
| Formula | C16H10O5 |
| Net Charge | 0 |
| Average Mass | 282.251 |
| Monoisotopic Mass | 282.05282 |
| SMILES | COc1c(C=O)c(O)cc2c1C(=O)c1ccccc1C2=O |
| InChI | InChI=1S/C16H10O5/c1-21-16-11(7-17)12(18)6-10-13(16)15(20)9-5-3-2-4-8(9)14(10)19/h2-7,18H,1H3 |
| InChIKey | IPDMWUNUULAXLU-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-hydroxy-1-methoxy-9,10-dioxo-2-anthracenecarboxaldehyde (CHEBI:93633) is a aldehyde (CHEBI:17478) |
| 3-hydroxy-1-methoxy-9,10-dioxo-2-anthracenecarboxaldehyde (CHEBI:93633) is a monohydroxyanthraquinone (CHEBI:37483) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4099 | LINCS |