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CHEBI:747480 - atractylenolide I

Default Structure
ChEBI IDCHEBI:747480
ChEBI Nameatractylenolide I
Stars
DefinitionA class of lactone compounds derived from Atractylodes macrocephala Koidz having anti-cancer, anti-inflammatory, and neuroprotective activities
Last Modified2 April 2026
SubmitterAnneNiknejad
DownloadsMolfile
FormulaC15H18O2
Net Charge0
Average Mass230.307
Monoisotopic Mass230.13068
SMILES[H][C@@]12CC3=C(C)C(=O)OC3=C[C@@]1(C)CCCC2=C
InChIInChI=1S/C15H18O2/c1-9-5-4-6-15(3)8-13-11(7-12(9)15)10(2)14(16)17-13/h8,12H,1,4-7H2,2-3H3/t12-,15+/m0/s1
InChIKeyZTVSGQPHMUYCRS-SWLSCSKDSA-N
ChEBI Ontology
Outgoing Relation(s)
atractylenolide I (CHEBI:747480) is a organic molecular entity (CHEBI:50860)
Manual XrefsDatabases
C17885KEGG COMPOUND