CHEBI:207314 - 6-demethylsorbicillin

ChEBI IDCHEBI:207314
ChEBI Name6-demethylsorbicillin
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SubmitterMetaboLights
DownloadsMolfile
FormulaC13H14O3
Net Charge0
Average Mass218.252
Monoisotopic Mass218.09429
SMILESC/C=C/C=C/C(=O)c1cc(C)c(O)cc1O
InChIInChI=1S/C13H14O3/c1-3-4-5-6-11(14)10-7-9(2)12(15)8-13(10)16/h3-8,15-16H,1-2H3/b4-3+,6-5+
InChIKeyYNRLVGAXEGGYPN-VNKDHWASSA-N
Species of MetaboliteComponentSourceComments
Trichodermaspecies (ncbitaxon:1715253) - PubMed (19182418)
ChEBI Ontology
Outgoing Relation(s)
6-demethylsorbicillin (CHEBI:207314) is a resorcinols (CHEBI:33572)
IUPAC Name 
(2E,4E)-1-(2,4-dihydroxy-5-methylphenyl)hexa-2,4-dien-1-one
Manual XrefsDatabases
27024156ChemSpider