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CHEBI:205182 - Guignardone F

ChEBI IDCHEBI:205182
ChEBI NameGuignardone F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H24O5
Net Charge0
Average Mass308.374
Monoisotopic Mass308.16237
SMILESCC1(C)OC2=C(C[C@H]3[C@H]1CC[C@@]3(C)O)C(=O)[C@]1(O)CO[C@H]2C1
InChIInChI=1S/C17H24O5/c1-15(2)10-4-5-16(3,19)11(10)6-9-13(22-15)12-7-17(20,8-21-12)14(9)18/h10-12,19-20H,4-8H2,1-3H3/t10-,11+,12+,16-,17-/m1/s1
InChIKeyXJXFAXABLHFWSI-PRNVEUERSA-N
Species of MetaboliteComponentSourceComments
Phyllosticta capitalensis (ncbitaxon:121624) - PubMed (23118716)
ChEBI Ontology
Outgoing Relation(s)
Guignardone F (CHEBI:205182) is a cyclohexenones (CHEBI:48953)
IUPAC Name 
(1S,5R,8R,9S,13R)-8,13-dihydroxy-4,4,8-trimethyl-3,15-dioxatetracyclo[11.2.1.02,11.05,9]hexadec-2(11)-en-12-one
Manual XrefsDatabases
29215070ChemSpider