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CHEBI:217458 - Dothiorelone F

ChEBI IDCHEBI:217458
ChEBI NameDothiorelone F
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H28O5
Net Charge0
Average Mass324.417
Monoisotopic Mass324.19367
SMILESCCCCCCC[C@H](OC)c1c(O)cc(O)cc1CC(=O)OC
InChIInChI=1S/C18H28O5/c1-4-5-6-7-8-9-16(22-2)18-13(11-17(21)23-3)10-14(19)12-15(18)20/h10,12,16,19-20H,4-9,11H2,1-3H3/t16-/m0/s1
InChIKeyUFRWFJVDTNWWGX-INIZCTEOSA-N
Species of MetaboliteComponentSourceComments
Dothiorellaspecies (ncbitaxon:2025944) - DOI (10.1007/s10600-014-0915-y)
ChEBI Ontology
Outgoing Relation(s)
Dothiorelone F (CHEBI:217458) is a benzyl ether (CHEBI:59859)
IUPAC Name 
methyl 2-[3,5-dihydroxy-2-(1-methoxyoctyl)phenyl]acetate
Manual XrefsDatabases
32674606ChemSpider