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CHEBI:203823 - Xialenone A

ChEBI IDCHEBI:203823
ChEBI NameXialenone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H14O3
Net Charge0
Average Mass194.230
Monoisotopic Mass194.09429
SMILESC=CC[C@@H]1C2=C(CC[C@@H]2O)C(=O)[C@@H]1O
InChIInChI=1S/C11H14O3/c1-2-3-6-9-7(4-5-8(9)12)11(14)10(6)13/h2,6,8,10,12-13H,1,3-5H2/t6-,8+,10-/m1/s1
InChIKeyWRTJJSJPZOTENC-KDILMLJESA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - DOI (10.1002/1099-0690(200007)2000:13<2401::aid-ejoc2401>3.0.co;2-y)
ChEBI Ontology
Outgoing Relation(s)
Xialenone A (CHEBI:203823) is a secondary alcohol (CHEBI:35681)
IUPAC Name 
(2R,3R,4S)-2,4-dihydroxy-3-prop-2-enyl-3,4,5,6-tetrahydro-2H-pentalen-1-one
Manual XrefsDatabases
8854695ChemSpider