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CHEBI:214827 - Koninginin U

ChEBI IDCHEBI:214827
ChEBI NameKoninginin U
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H18O3
Net Charge0
Average Mass210.273
Monoisotopic Mass210.12559
SMILESCCC[C@]1(O)CCC2=C(CCCC2=O)O1
InChIInChI=1S/C12H18O3/c1-2-7-12(14)8-6-9-10(13)4-3-5-11(9)15-12/h14H,2-8H2,1H3/t12-/m1/s1
InChIKeyNYWDNCMJSZYMGN-GFCCVEGCSA-N
Species of MetaboliteComponentSourceComments
Phomopsis stipata (ncbitaxon:520419) - DOI (10.1016/j.phytol.2020.01.019)
ChEBI Ontology
Outgoing Relation(s)
Koninginin U (CHEBI:214827) is a benzopyran (CHEBI:22727)
IUPAC Name 
(2R)-2-hydroxy-2-propyl-4,6,7,8-tetrahydro-3H-chromen-5-one