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CHEBI:217586 - (+)-(17R)-apralactone A

ChEBI IDCHEBI:217586
ChEBI Name(+)-(17R)-apralactone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H20O6
Net Charge0
Average Mass332.352
Monoisotopic Mass332.12599
SMILESC[C@@H]1CCC/C=C/C2(O)CC(=O)c3c(cc(O)cc3O2)CC(=O)O1
InChIInChI=1S/C18H20O6/c1-11-5-3-2-4-6-18(22)10-14(20)17-12(8-16(21)23-11)7-13(19)9-15(17)24-18/h4,6-7,9,11,19,22H,2-3,5,8,10H2,1H3/b6-4+/t11-,18?/m1/s1
InChIKeyNXIOMVOFGLOKLL-FXEKUBAXSA-N
Species of MetaboliteComponentSourceComments
Curvularia (ncbitaxon:5502) - PubMed (24260014)
ChEBI Ontology
Outgoing Relation(s)
(+)-(17R)-apralactone A (CHEBI:217586) is a chromones (CHEBI:23238)
IUPAC Name 
(9R,13E)-3,15-dihydroxy-9-methyl-8,19-dioxatricyclo[13.3.1.05,18]nonadeca-1,3,5(18),13-tetraene-7,17-dione
Manual XrefsDatabases
27023390ChemSpider