Description
IUPAC Name: (4aS,8aS)-3,8a-dimethyl-5-methylidene-4a,6,7,8-tetrahydro-4H-benzo[f][1]benzofuran-2-one
InChI: InChI=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
InChIKey: ZTVSGQPHMUYCRS-SWLSCSKDSA-N
Canonical SMILES: CC1=C2CC3C(=C)CCCC3(C=C2OC1=O)C
Isomeric SMILES: CC1=C2C[C@H]3C(=C)CCC[C@@]3(C=C2OC1=O)C
Synonyms: Atractylenolide I; 73069-13-3; Atractylenolide-1; AtractylenolideI; Atractylenolide 1; Atractylenolide-I; CHEMBL449520; (4aS,8aS)-3,8a-dimethyl-5-methylidene-4a,6,7,8-tetrahydro-4H-benzo[f][1]benzofuran-2-one; …
Botanical Source: Atractylodes macrocephala