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CHEBI:208170 - Xylariacyclone B

ChEBI IDCHEBI:208170
ChEBI NameXylariacyclone B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H14O6
Net Charge0
Average Mass230.216
Monoisotopic Mass230.07904
SMILESCOC1=CC(=O)[C@H](OC(C)=O)[C@@](C)(O)[C@H]1O
InChIInChI=1S/C10H14O6/c1-5(11)16-9-6(12)4-7(15-3)8(13)10(9,2)14/h4,8-9,13-14H,1-3H3/t8-,9-,10-/m0/s1
InChIKeyODYIVPXZDYKWBQ-GUBZILKMSA-N
Species of MetaboliteComponentSourceComments
Xylaria (ncbitaxon:37991) - DOI (10.1016/j.tet.2013.10.063)
ChEBI Ontology
Outgoing Relation(s)
Xylariacyclone B (CHEBI:208170) is a cyclohexenones (CHEBI:48953)
IUPAC Name 
[(1R,5R,6S)-5,6-dihydroxy-4-methoxy-6-methyl-2-oxocyclohex-3-en-1-yl] acetate
Manual XrefsDatabases
78437910ChemSpider