CHEBI:68294 - inumakilactone B

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ChEBI Name inumakilactone B
ChEBI ID CHEBI:68294
Definition A diterpene lactone isolated from Podocarpus latifolius and has been shown to exhibit inhibitory activity against activator protein 1 (AP-1).
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C18H18O7
Net Charge 0
Average Mass 346.33130
Monoisotopic Mass 346.10525
InChI InChI=1S/C18H18O7/c1-4-7-18-6(5-8(19)22-7)16(2)11-9(14(18)25-18)24-15(21)17(11,3)12(20)10-13(16)23-10/h4-5,7,9-14,20H,1H2,2-3H3/t7-,9+,10-,11-,12+,13-,14-,16-,17-,18-/m1/s1
InChIKey VLRYBJQMQSJMHB-UNJPOVPCSA-N
SMILES [H][C@]12O[C@@]1([H])[C@]1(C)C3=CC(=O)O[C@H](C=C)[C@]33O[C@@H]3[C@@]3([H])OC(=O)[C@@](C)([C@H]2O)[C@@]13[H]
Metabolite of Species Details
Podocarpus latifolius (NCBI:txid120620) Found in root (BTO:0001188). Previous component: root bark; CH2Cl2-MeOH(1:1) extract of dried, ground root bark See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
AP-1 antagonist
An antogonist that interferes with the action of activator protein 1 (AP-1).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing inumakilactone B (CHEBI:68294) has role AP-1 antagonist (CHEBI:67199)
inumakilactone B (CHEBI:68294) has role metabolite (CHEBI:25212)
inumakilactone B (CHEBI:68294) is a γ-lactone (CHEBI:37581)
inumakilactone B (CHEBI:68294) is a δ-lactone (CHEBI:18946)
inumakilactone B (CHEBI:68294) is a diterpene lactone (CHEBI:49193)
inumakilactone B (CHEBI:68294) is a epoxide (CHEBI:32955)
inumakilactone B (CHEBI:68294) is a organic heterohexacyclic compound (CHEBI:51914)
IUPAC Name
(1aR,1bS,3aR,3bR,4R,4aR,5aS,5bS,9R,9aR)-9-ethenyl-4-hydroxy-3a,5b-dimethyl-1a,1b,3a,3b,4,4a,5a,5b-octahydro-3H,7H-oxireno[5,6][2]benzofuro[7,1-fg]oxireno[i]isochromene-3,7-dione
Registry Number Type Source
19894434 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21306129 PubMed citation Europe PMC
Last Modified
21 August 2013