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CHEBI:217729 - Dothiorelone M

ChEBI IDCHEBI:217729
ChEBI NameDothiorelone M
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H30O6
Net Charge0
Average Mass414.498
Monoisotopic Mass414.20424
SMILESCCCCCCCC(=O)c1c(O)cc(O)cc1CC(=O)OCCc1ccc(O)cc1
InChIInChI=1S/C24H30O6/c1-2-3-4-5-6-7-21(27)24-18(14-20(26)16-22(24)28)15-23(29)30-13-12-17-8-10-19(25)11-9-17/h8-11,14,16,25-26,28H,2-7,12-13,15H2,1H3
InChIKeyWGTOTSBHFNRGHY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Diaporthe (ncbitaxon:36922) - PubMed (29660469)
ChEBI Ontology
Outgoing Relation(s)
Dothiorelone M (CHEBI:217729) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
2-(4-hydroxyphenyl)ethyl 2-(3,5-dihydroxy-2-octanoylphenyl)acetate