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CHEBI:69339 - carpesiolin
| Formula | C15H20O4 |
| Net Charge | 0 |
| Average Mass | 264.321 |
| Monoisotopic Mass | 264.13616 |
| SMILES | [H][C@@]12CCC(=O)[C@@]1(C)[C@@H](O)[C@]1([H])C(=C)C(=O)O[C@@]1([H])C[C@H]2C |
| InChI | InChI=1S/C15H20O4/c1-7-6-10-12(8(2)14(18)19-10)13(17)15(3)9(7)4-5-11(15)16/h7,9-10,12-13,17H,2,4-6H2,1,3H3/t7-,9+,10+,12-,13+,15+/m1/s1 |
| InChIKey | IOUNDPHKKPZPKB-GSNHZRAGSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Inula hupehensis (IPNI:225932-1) | aerial part (BTO:0001658) | PubMed (21894898) | 95% aqueous EtOH extract of dried and powdered aerial parts |
| Roles Classification |
|---|
| Biological Roles: | metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. |
| Application: | anti-inflammatory agent Any compound that has anti-inflammatory effects. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| carpesiolin (CHEBI:69339) has role anti-inflammatory agent (CHEBI:67079) |
| carpesiolin (CHEBI:69339) has role metabolite (CHEBI:25212) |
| carpesiolin (CHEBI:69339) has role plant metabolite (CHEBI:76924) |
| carpesiolin (CHEBI:69339) is a cyclic ketone (CHEBI:3992) |
| carpesiolin (CHEBI:69339) is a organic heterotricyclic compound (CHEBI:26979) |
| carpesiolin (CHEBI:69339) is a secondary alcohol (CHEBI:35681) |
| carpesiolin (CHEBI:69339) is a sesquiterpene lactone (CHEBI:37667) |
| carpesiolin (CHEBI:69339) is a γ-lactone (CHEBI:37581) |
| IUPAC Name |
|---|
| (3aS,4S,4aR,7aS,8R,9aS)-4-hydroxy-4a,8-dimethyl-3-methylidenedecahydroazuleno[6,5-b]furan-2,5-dione |
| Synonyms | Source |
|---|---|
| 4-oxo-6-hydroxypseudoguai-11(13)-en-8,12-olide | ChEBI |
| 6α-hydroxy-2,3-dihydroaromaticin | ChEBI |
| Registry Numbers | Sources |
|---|---|
| Reaxys:6571345 | Reaxys |
| Citations |
|---|