CHEBI:181113 - 5a,9-Dimethyl-3-methylidene-3a,4,6,7,8,9b-hexahydrobenzo[g][1]benzofuran-2,5-dione

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ChEBI Name 5a,9-Dimethyl-3-methylidene-3a,4,6,7,8,9b-hexahydrobenzo[g][1]benzofuran-2,5-dione
ChEBI ID CHEBI:181113
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H18O3
Net Charge 0
Average Mass 246.306
Monoisotopic Mass 246.12559
InChI InChI=1S/C15H18O3/c1-8-5-4-6-15(3)11(16)7-10-9(2)14(17)18-13(10)12(8)15/h10,13H,2,4-7H2,1,3H3
InChIKey CPHPAWJXZHHPEN-UHFFFAOYSA-N
SMILES O1C2C=3C(CCCC3C)(C(=O)CC2C(C1=O)=C)C
ChEBI Ontology
Outgoing 5a,9-Dimethyl-3-methylidene-3a,4,6,7,8,9b-hexahydrobenzo[g][1]benzofuran-2,5-dione (CHEBI:181113) is a sesquiterpene lactone (CHEBI:37667)
IUPAC Name
5a,9-dimethyl-3-methylidene-3a,4,6,7,8,9b-hexahydrobenzo[g][1]benzouran-2,5-dione