(3,6,9-trimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-8-yl) acetate (CHEBI:181766)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	(3,6,9-trimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-8-yl) acetate

ChEBI ID	CHEBI:181766

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C17H20O4

Net Charge

Average Mass

288.343

Monoisotopic Mass

288.13616

InChI

InChI=1S/C17H20O4/c1-8-5-6-12-9(2)17(19)21-16(12)15-10(3)14(7-13(8)15)20-11(4)18/h12-16H,1-3,5-7H2,4H3

InChIKey

GKMFOEIZCLMZDE-UHFFFAOYSA-N

SMILES

O1C2C3C(CC(OC(=O)C)C3=C)C(CCC2C(C1=O)=C)=C

ChEBI Ontology
Outgoing	(3,6,9-trimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-8-yl) acetate (CHEBI:181766) is a sesquiterpene lactone (CHEBI:37667)

IUPAC Name

(3,6,9-trimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]uran-8-yl) acetate