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CHEBI:175837 - alpha-Peroxyachifolide

ChEBI IDCHEBI:175837
ChEBI Namealpha-Peroxyachifolide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H24O7
Net Charge0
Average Mass376.405
Monoisotopic Mass376.15220
SMILES[H][C@]12OC(=O)C(=C)[C@]1([H])C[C@@H](O)[C@@](C)(OC(=O)/C(C)=C/C)[C@@]13C=C[C@](C)(OO1)[C@]23[H]
InChIInChI=1S/C20H24O7/c1-6-10(2)16(22)25-19(5)13(21)9-12-11(3)17(23)24-14(12)15-18(4)7-8-20(15,19)27-26-18/h6-8,12-15,21H,3,9H2,1-2,4-5H3/b10-6+/t12-,13+,14-,15-,18-,19+,20-/m0/s1
InChIKeyUMHHYRUGXILZJB-SUPYAJSZSA-N
ChEBI Ontology
Outgoing Relation(s)
alpha-Peroxyachifolide (CHEBI:175837) is a sesquiterpene lactone (CHEBI:37667)
IUPAC Name 
[(1S,2R,3R,5S,9S,10S,11S)-3-hydroxy-2,11-dimethyl-6-methylidene-7-oxo-8,12,13-trioxatetracyclo[9.2.2.01,10.05,9]pentadec-14-en-2-yl] (E)-2-methylbut-2-enoate