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CHEBI:207102 - Stagonolide J

ChEBI IDCHEBI:207102
ChEBI NameStagonolide J
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H20O4
Net Charge0
Average Mass228.288
Monoisotopic Mass228.13616
SMILESCCC[C@@H]1OC(=O)CCC/C=C/[C@H](O)[C@H]1O
InChIInChI=1S/C12H20O4/c1-2-6-10-12(15)9(13)7-4-3-5-8-11(14)16-10/h4,7,9-10,12-13,15H,2-3,5-6,8H2,1H3/b7-4+/t9-,10-,12+/m0/s1
InChIKeyIZFXFVSOQMEZKB-HLNHWMSTSA-N
Species of MetaboliteComponentSourceComments
Stagonospora (ncbitaxon:54788) - PubMed (31670962)
ChEBI Ontology
Outgoing Relation(s)
Stagonolide J (CHEBI:207102) is a oxacycle (CHEBI:38104)
IUPAC Name 
(2S,3R,4S,5E)-3,4-dihydroxy-2-propyl-2,3,4,7,8,9-hexahydrooxecin-10-one