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CHEBI:190360 - Annuolide E

ChEBI IDCHEBI:190360
ChEBI NameAnnuolide E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O3
Net Charge0
Average Mass248.322
Monoisotopic Mass248.14124
SMILESC=C1C(O)CC2C(C)C(=O)OC2C2C(=C)CCC12
InChIInChI=1S/C15H20O3/c1-7-4-5-10-8(2)12(16)6-11-9(3)15(17)18-14(11)13(7)10/h9-14,16H,1-2,4-6H2,3H3
InChIKeyNMUKFBVCUMTQOB-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) intestinal content (NCIT:C189653) MetaboLights (MTBLS4101) Strain: C57BL/6J  [EFO:0000606]
ChEBI Ontology
Outgoing Relation(s)
Annuolide E (CHEBI:190360) is a sesquiterpene lactone (CHEBI:37667)
IUPAC Name 
5-hydroxy-3-methyl-6,9-dimethylidene-3a,4,5,6a,7,8,9a,9b-octahydro-3H-azuleno[4,5-b]uran-2-one
Manual XrefsDatabases
35014547ChemSpider
HMDB0038326HMDB