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CHEBI:200829 - 9-acetyldiorcinol B

ChEBI IDCHEBI:200829
ChEBI Name9-acetyldiorcinol B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H26O6
Net Charge0
Average Mass374.433
Monoisotopic Mass374.17294
SMILESCC(=O)O[C@@H](Cc1c(C)cc(O)cc1Oc1cc(C)cc(O)c1)C(C)(C)O
InChIInChI=1S/C21H26O6/c1-12-6-15(23)9-17(7-12)27-19-10-16(24)8-13(2)18(19)11-20(21(4,5)25)26-14(3)22/h6-10,20,23-25H,11H2,1-5H3/t20-/m0/s1
InChIKeyNTAFGSZVOYFBDV-FQEVSTJZSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (25038471)
ChEBI Ontology
Outgoing Relation(s)
9-acetyldiorcinol B (CHEBI:200829) is a aromatic ether (CHEBI:35618)
IUPAC Name 
[(2S)-3-hydroxy-1-[4-hydroxy-2-(3-hydroxy-5-methylphenoxy)-6-methylphenyl]-3-methylbutan-2-yl] acetate
Manual XrefsDatabases
78441992ChemSpider