EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C25H26O6 |
| Net Charge | 0 |
| Average Mass | 422.477 |
| Monoisotopic Mass | 422.17294 |
| SMILES | CC12CCC3C1C(c1cc(C4CC(=O)c5c(O)cc(O)cc5O4)c(O)cc1O2)C3(C)C |
| InChI | InChI=1S/C25H26O6/c1-24(2)14-4-5-25(3)23(14)22(24)13-8-12(15(27)9-19(13)31-25)18-10-17(29)21-16(28)6-11(26)7-20(21)30-18/h6-9,14,18,22-23,26-28H,4-5,10H2,1-3H3 |
| InChIKey | IJVOVAHXZFALHZ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Kuwanon D (CHEBI:175376) is a flavanones (CHEBI:28863) |
| IUPAC Name |
|---|
| 5,7-dihydroxy-2-(5-hydroxy-9,13,13-trimethyl-8-oxatetracyclo[7.4.1.02,7.012,14]tetradeca-2(7),3,5-trien-4-yl)-2,3-dihydrochromen-4-one |
| Manual Xrefs | Databases |
|---|---|
| LMPK12140528 | LIPID MAPS |
| HMDB0030861 | HMDB |
| 2339131 | ChemSpider |
| Registry Numbers | Sources |
|---|---|
| CAS:67172-84-3 | ChemIDplus |