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CHEBI:4817 - Eremofrullanolide

ChEBI IDCHEBI:4817
ChEBI NameEremofrullanolide
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC15H20O2
Net Charge0
Average Mass232.323
Monoisotopic Mass232.14633
SMILES[H][C@@]12C[C@@]3(C)C(=C[C@]1([H])OC(=O)C2=C)CCC[C@@H]3C
InChIInChI=1S/C15H20O2/c1-9-5-4-6-11-7-13-12(8-15(9,11)3)10(2)14(16)17-13/h7,9,12-13H,2,4-6,8H2,1,3H3/t9-,12-,13-,15+/m0/s1
InChIKeyOAPAQBTVYKCGMG-SUDQYYNISA-N
ChEBI Ontology
Outgoing Relation(s)
Eremofrullanolide (CHEBI:4817) is a sesquiterpene lactone (CHEBI:37667)
Synonym  Source
EremofrullanolideKEGG COMPOUND
Manual XrefsDatabases
C09408KEGG COMPOUND
C00003258KNApSAcK
Registry NumbersSources
CAS:62870-69-3KEGG COMPOUND