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CHEBI:220244 - Koninginin R

ChEBI IDCHEBI:220244
ChEBI NameKoninginin R
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H28O6
Net Charge0
Average Mass340.416
Monoisotopic Mass340.18859
SMILESCCCCCC[C@H](O)[C@@H]1C[C@@H](OC(C)=O)C2=C(O1)[C@H](O)CCC2=O
InChIInChI=1S/C18H28O6/c1-3-4-5-6-7-12(20)15-10-16(23-11(2)19)17-13(21)8-9-14(22)18(17)24-15/h12,14-16,20,22H,3-10H2,1-2H3/t12-,14+,15-,16+/m0/s1
InChIKeyGXYWRLQZWPUUNP-DRPJVOAASA-N
Species of MetaboliteComponentSourceComments
Trichoderma koningiopsis (ncbitaxon:337941) - PubMed (27784167)
ChEBI Ontology
Outgoing Relation(s)
Koninginin R (CHEBI:220244) is a benzopyran (CHEBI:22727)
IUPAC Name 
[(2S,4R,8R)-8-hydroxy-2-[(1S)-1-hydroxyheptyl]-5-oxo-2,3,4,6,7,8-hexahydrochromen-4-yl] acetate
Manual XrefsDatabases
78441847ChemSpider