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CHEBI:203703 - Mueggelone

ChEBI IDCHEBI:203703
ChEBI NameMueggelone
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H28O3
Net Charge0
Average Mass292.419
Monoisotopic Mass292.20384
SMILESCC/C=C\C[C@@H]1O[C@H]1/C=C/C1CCCCCCCC(=O)O1
InChIInChI=1S/C18H28O3/c1-2-3-7-11-16-17(21-16)14-13-15-10-8-5-4-6-9-12-18(19)20-15/h3,7,13-17H,2,4-6,8-12H2,1H3/b7-3-,14-13+/t15?,16-,17-/m0/s1
InChIKeyNQKZDMRQSOUOJH-RMOHKNCISA-N
Species of MetaboliteComponentSourceComments
Aphanizomenon flos-aquae (ncbitaxon:1176) - PubMed (9428164)
ChEBI Ontology
Outgoing Relation(s)
Mueggelone (CHEBI:203703) is a lactone (CHEBI:25000)
IUPAC Name 
10-[(E)-2-[(2S,3S)-3-[(Z)-pent-2-enyl]oxiran-2-yl]ethenyl]oxecan-2-one
Manual XrefsDatabases
8441838ChemSpider