EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H12O5 |
| Net Charge | 0 |
| Average Mass | 284.267 |
| Monoisotopic Mass | 284.06847 |
| SMILES | [H]C12COc3cc(O)ccc3C1([H])Oc1cc3c(cc12)OCO3 |
| InChI | InChI=1S/C16H12O5/c17-8-1-2-9-12(3-8)18-6-11-10-4-14-15(20-7-19-14)5-13(10)21-16(9)11/h1-5,11,16-17H,6-7H2 |
| InChIKey | HUKSJTUUSUGIDC-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| maackiain (CHEBI:73029) is a phenols (CHEBI:33853) |
| maackiain (CHEBI:73029) is a pterocarpans (CHEBI:26377) |
| Incoming Relation(s) |
| (+)-maackiain (CHEBI:73030) is a maackiain (CHEBI:73029) |
| (−)-maackiain (CHEBI:99) is a maackiain (CHEBI:73029) |
| IUPAC Name |
|---|
| 6a,12a-dihydro-6H-[1,3]dioxolo[5,6][1]benzofuro[3,2-c]chromen-3-ol |
| Synonym | Source |
|---|---|
| 3-hydroxy-8,9-methylenedioxypterocarpane | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| LSM-1932 | LINCS |