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CHEBI:174307 - Cadabicilone

ChEBI IDCHEBI:174307
ChEBI NameCadabicilone
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O3
Net Charge0
Average Mass250.338
Monoisotopic Mass250.15689
SMILESCC1C(=O)OC2C1CCC1(C)CCC(=O)C(C)C21
InChIInChI=1S/C15H22O3/c1-8-10-4-6-15(3)7-5-11(16)9(2)12(15)13(10)18-14(8)17/h8-10,12-13H,4-7H2,1-3H3
InChIKeyBXRGGUXPWTWACZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Cadabicilone (CHEBI:174307) is a sesquiterpene lactone (CHEBI:37667)
IUPAC Name 
3,5a,9-trimethyl-3a,4,5,6,7,9,9a,9b-octahydro-3H-benzo[g][1]benzouran-2,8-dione
Manual XrefsDatabases
288033ChemSpider
HMDB0037559HMDB