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CHEBI:10076 - Xerantholide

ChEBI IDCHEBI:10076
ChEBI NameXerantholide
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC15H18O3
Net Charge0
Average Mass246.306
Monoisotopic Mass246.12559
SMILES[H][C@@]12CC(=O)C(C)=C1C[C@]1([H])C(=C)C(=O)O[C@@]1([H])C[C@@H]2C
InChIInChI=1S/C15H18O3/c1-7-4-14-12(9(3)15(17)18-14)5-11-8(2)13(16)6-10(7)11/h7,10,12,14H,3-6H2,1-2H3/t7-,10-,12+,14-/m0/s1
InChIKeyUQNONRHPSCIIJO-BNYHBGRESA-N
ChEBI Ontology
Outgoing Relation(s)
Xerantholide (CHEBI:10076) is a sesquiterpene lactone (CHEBI:37667)
Synonym  Source
XerantholideKEGG COMPOUND
Manual XrefsDatabases
C09605KEGG COMPOUND
C00003396KNApSAcK
Registry NumbersSources
CAS:65017-97-2KEGG COMPOUND