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CHEBI:173202 - Sequiterpene Lactone 326

Default Structure
ChEBI IDCHEBI:173202
ChEBI NameSequiterpene Lactone 326
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O4
Net Charge0
Average Mass264.321
Monoisotopic Mass264.13616
SMILESC=C1C(=O)OC2CC(C)C3(O)CCC(=O)C3(C)CC12
InChIInChI=1S/C15H20O4/c1-8-6-11-10(9(2)13(17)19-11)7-14(3)12(16)4-5-15(8,14)18/h8,10-11,18H,2,4-7H2,1,3H3
InChIKeyJPWMRQZYTCWJHW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) feces (BTO:0000440) MetaboLights (MTBLS2721)
ChEBI Ontology
Outgoing Relation(s)
Sequiterpene Lactone 326 (CHEBI:173202) is a sesquiterpene lactone (CHEBI:37667)
IUPAC Name 
5a-hydroxy-5,8a-dimethyl-1-methylidene-4,5,6,7,9,9a-hexahydro-3aH-azuleno[6,7-b]uran-2,8-dione
Manual XrefsDatabases
300181ChemSpider