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CHEBI:203959 - Oxirapentyn K

ChEBI IDCHEBI:203959
ChEBI NameOxirapentyn K
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H24O7
Net Charge0
Average Mass352.383
Monoisotopic Mass352.15220
SMILESCC(=O)O[C@@H]1C[C@]23O[C@H]2C2=C(C(=O)CC(C)(C)O2)[C@@H](O)[C@@H]3OC1(C)C
InChIInChI=1S/C18H24O7/c1-8(19)22-10-7-18-14(24-17(10,4)5)12(21)11-9(20)6-16(2,3)23-13(11)15(18)25-18/h10,12,14-15,21H,6-7H2,1-5H3/t10-,12-,14+,15+,18-/m1/s1
InChIKeyQTHPDXJRVSEFDY-FYEODOKUSA-N
Species of MetaboliteComponentSourceComments
Isaria (ncbitaxon:72232) - PubMed (24911656)
ChEBI Ontology
Outgoing Relation(s)
Oxirapentyn K (CHEBI:203959) is a pyranone (CHEBI:37963)
IUPAC Name 
[(1R,3S,10R,11S,14R)-10-hydroxy-6,6,13,13-tetramethyl-8-oxo-2,5,12-trioxatetracyclo[9.4.0.01,3.04,9]pentadec-4(9)-en-14-yl] acetate
Manual XrefsDatabases
32674939ChemSpider